SCHEMBL13405656

SCHEMBL13405656

O=C(CC(CC(=O)c1ccccc1)C(=O)c1ccccc1)c1ccccc1

nearest known ligand 0.73

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TSHR P16473 1/20 0.73
KMT2A Q03164 3/20 0.61
MEN1 O00255 2/20 0.59
NPC1 O15118 2/20 0.59
MAPT P10636 5/20 0.54
MAPK1 P28482 3/20 0.54
TDP1 Q9NUW8 3/20 0.54
SMN1; SMN2 Q16637 3/20 0.54
HPGD P15428 2/20 0.54
KDM4E B2RXH2 2/20 0.54
CES1 P23141 2/20 0.54
CYP3A4 P08684 1/20 0.54
ALOX15 P16050 1/20 0.54
ALDH1A1 P00352 4/20 0.50
GSK3B P49841 2/20 0.50
HTT P42858 2/20 0.50
PTPN1 P18031 2/20 0.50
TRPA1 O75762 1/20 0.50
HIF1A Q16665 1/20 0.50
RAB9A P51151 1/20 0.50

Click a target to see other patent compounds predicted against it — the reverse direction, in place.

Similar compounds — the chemically nearest patent molecules

Nearest neighbours by Morgan-fingerprint cosine across the patent-compound collection, with each neighbour's top predicted target and the predicted targets it shares with this molecule.

Compoundsimilaritytop predictedshared targets
SCHEMBL25645644 0.88 TSHR (0.63) TSHRKMT2AMEN1NPC1MAPT
SCHEMBL9196452 0.84 HTT (0.71) TSHRKMT2AMEN1NPC1MAPT
SCHEMBL10958829 0.81 TSHR (0.64) TSHRKMT2AMEN1NPC1MAPT
SCHEMBL11070861 0.79 TSHR (0.57) TSHRKMT2AMEN1NPC1MAPT
SCHEMBL25645639 0.79 L3MBTL1 (0.64) TSHRKMT2AMEN1NPC1MAPT
SCHEMBL8534214 0.79 TSHR (0.57) TSHRKMT2AMEN1NPC1MAPT
SCHEMBL3693703 0.78 TSHR (0.78) TSHRKMT2AMEN1NPC1MAPT
SCHEMBL10862020 0.78 TSHR (0.55) TSHRKMT2AMEN1NPC1MAPT
SCHEMBL6201780 0.78 LMNA (0.65) TSHRKMT2AMEN1MAPTMAPK1
SCHEMBL9350244 0.77 MAPT (0.53) TSHRKMT2AMEN1NPC1MAPT

Similarity is cosine over the 2,048-bit Morgan fingerprint (≈ Tanimoto). Identical fingerprints score 1.00.

Patent provenance — the patents this molecule appears in, and who filed them

Claimed or disclosed in 21 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8354453-B2 Bupropion hydrobromide and therapeutic applications VALEANT INTERNATIONAL BERMUDA (BM) 2013-01-15 US disclosed
US-20100104639-A1 BUPROPION HYDROBROMIDE AND THERAPEUTIC APPLICATIONS BIOVAIL LABORATORIES INTERNATIONAL S.R.L. (BB) 2010-04-29 US disclosed
US-7671094-B2 Bupropion hydrobromide and therapeutic applications BIOVAIL LABORATORIES INTERNATIONAL S.R.L. (BB) 2010-03-02 US disclosed
US-7649019-B2 controlled release tablet of bupropion hydrobromide for reducing the ratio of the maximum/minimum plasma bupropion hydrobromide concentration (Cmax/Cmin) while maintaining bupropion plasma levels within the therapeutic window upon administration to a patient; more stable than buproin hcl BIOVAIL LABORATORIES INTERNATIONAL S.R.L. (BB) 2010-01-19 US disclosed
US-7645901-B2 Crystal form; controlled release tablet of bupropion hydrobromide for reducing the ratio of the maximum/minimum plasma bupropion hydrobromide concentration (Cmax/Cmin) while maintaining bupropion plasma levels within the therapeutic window upon administration to a patient; more stable than buproin hcl BIOVAIL LABORATORIES INTERNATIONAL S.R.L. (BB) 2010-01-12 US disclosed
US-7645802-B2 Controlled release, once daily formulation; reducing seizure side effects; antidepressant BIOVAIL LABORATORIES INTERNATIONAL SRL. (BB) 2010-01-12 US disclosed
US-7585897-B2 Core comprising bupropion hydrobromide, binder, lubricant, and time-release coating surrounding core; storage stability BIOVAIL LABORATORIES INTERNATIONAL S.R.L. (BB) 2009-09-08 US disclosed
US-7579380-B2 Microparticles having osmotic subcoat; extended release tablets; shelf life; hydrobromide form BIOVAIL LABORATORIES INTERNATIONAL S.R.L. (BB) 2009-08-25 US disclosed
US-7569610-B2 Administering bupropion hydrobromide to treat seasonal affective, obsessive compulsive, post-traumatic stress, psychological, respiratory system, attention deficit/hyperactivity, sexual or sleep disorders; anxiolytic agents, antidepressants; neurpathic pain, fibromyalgia, viricides; headaches, obesity BIOVAIL LABORATORIES INTERNATIONAL SRL (BB) 2009-08-04 US disclosed
US-7563823-B2 Controlled release matrix BIOVAIL LABORATORIES INTERNATIONAL SRL. (BB) 2009-07-21 US disclosed
US-20080274181-A1 BUPROPION HYDROBROMIDE AND THERAPEUTIC APPLICATIONS BIOAVAIL LABORATORIES INTERNATIONAL S.R.L. (BB) 2008-11-06 US disclosed
US-20080081068-A1 Core comprising bupropion hydrobromide, binder, lubricant, and time-release coating surrounding core; storage stability BIOVAIL LABORATORIES INTERNATIONAL S.R.L. (BB) 2008-04-03 US disclosed
US-20080075774-A1 BUPROPION HYDROBROMIDE AND THERAPEUTIC APPLICATIONS BIOAVAIL LABORATORIES INTERNATIONAL S.R.L. (BB) 2008-03-27 US disclosed
US-20080057120-A1 controlled release tablet of bupropion hydrobromide for reducing the ratio of the maximum/minimum plasma bupropion hydrobromide concentration (Cmax/Cmin) while maintaining bupropion plasma levels within the therapeutic window upon administration to a patient; more stable than buproin hcl BIOAVAIL LABORATORIES INTERNATIONAL S.R.L. (BB) 2008-03-06 US disclosed
US-20080038345-A1 Microparticles having osmotic subcoat; extended release tablets; shelf life; hydrobromide form BIOAVAIL LABORATORIES (BB) 2008-02-14 US disclosed
US-20080033044-A1 Crystal form; controlled release tablet of bupropion hydrobromide for reducing the ratio of the maximum/minimum plasma bupropion hydrobromide concentration (Cmax/Cmin) while maintaining bupropion plasma levels within the therapeutic window upon administration to a patient; more stable than buproin hcl BIOAVAIL LABORATORIES (BB) 2008-02-07 US disclosed
US-20070276047-A1 Administering bupropion hydrobromide to treat seasonal affective, obsessive compulsive, post-traumatic stress, psychological, respiratory system, attention deficit/hyperactivity, sexual or sleep disorders; anxiolytic agents, antidepressants; neurpathic pain, fibromyalgia, viricides; headaches, obesity BIOVAIL LABORATORIES INTERNATIONAL S.R.L. (BB) 2007-11-29 US disclosed
US-20070269516-A1 Controlled release matrix BIOAVAIL LABORATORIES INTERNATIONAL S.R.L. (BB) 2007-11-22 US disclosed
US-7241805-B2 For therapy of depressive condition BIOVAIL LABORATORIES, INC. (CA) 2007-07-10 US disclosed
US-20070027213-A1 For therapy of depressive condition BIOVAIL LABORATORIES INTERNATIONAL S.R.L. (CA) 2007-02-01 US disclosed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (10 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.

PatentTitleText reads most aboutPredicted target · text-rank
US-20080081068-A1 Core comprising bupropion hydrobromide, binder, lubricant, and time-release coating surrounding core; storage stability SLC6A2, SLC6A3, HTR5A TSHR 2980/4885KMT2A 1771/4885MEN1 3880/4885
US-20070276047-A1 Administering bupropion hydrobromide to treat seasonal affective, obsessive compulsive, post-traumatic stress, psychological, respiratory system, attention deficit/hyperactivity, sexual or sleep disorders; anxiolytic agents, antidepressants; neurpathic pain, fibromyalgia, viricides; headaches, obesity HCRTR2, HCRTR1, SLC6A2 TSHR 2155/4885KMT2A 3435/4885MEN1 4243/4885
US-20080057120-A1 controlled release tablet of bupropion hydrobromide for reducing the ratio of the maximum/minimum plasma bupropion hydrobromide concentration (Cmax/Cmin) while maintaining bupropion plasma levels within the therapeutic window upon administration to a patient; more stable than buproin hcl SLC6A2, BDNF, SLC6A11 TSHR 2219/4885KMT2A 2411/4885MEN1 413/4885
US-20080033044-A1 Crystal form; controlled release tablet of bupropion hydrobromide for reducing the ratio of the maximum/minimum plasma bupropion hydrobromide concentration (Cmax/Cmin) while maintaining bupropion plasma levels within the therapeutic window upon administration to a patient; more stable than buproin hcl BDNF, MME, SLC6A11 TSHR 2012/4885KMT2A 3338/4885MEN1 414/4885
US-20070027213-A1 For therapy of depressive condition SLC6A2, SLC6A4, HTR5A TSHR 1384/4885KMT2A 1485/4885MEN1 3892/4885
US-20080075774-A1 BUPROPION HYDROBROMIDE AND THERAPEUTIC APPLICATIONS GABBR1, SLC6A2, GABBR2 TSHR 1150/4885KMT2A 2830/4885MEN1 2766/4885
US-20070269516-A1 Controlled release matrix SLC6A2, SLC6A11, SLC6A1 TSHR 1691/4885KMT2A 1801/4885MEN1 3180/4885
US-20080274181-A1 BUPROPION HYDROBROMIDE AND THERAPEUTIC APPLICATIONS GABBR1, SLC6A2, GABBR2 TSHR 1150/4885KMT2A 2830/4885MEN1 2766/4885
US-20100104639-A1 BUPROPION HYDROBROMIDE AND THERAPEUTIC APPLICATIONS GABBR1, SLC6A2, GABBR2 TSHR 1150/4885KMT2A 2830/4885MEN1 2766/4885
US-20080038345-A1 Microparticles having osmotic subcoat; extended release tablets; shelf life; hydrobromide form SLC6A2, SLC6A4, SLC6A3 TSHR 2832/4885KMT2A 681/4885MEN1 3407/4885

“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.