SCHEMBL3342586

SCHEMBL3342586

O=C(CCC(=O)Nc1ccccc1)Nc1ccccc1

nearest known ligand 0.80

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
L3MBTL1 Q9Y468 2/20 0.80
MAPT P10636 2/20 0.73
HTT P42858 1/20 0.73
SMN1; SMN2 Q16637 1/20 0.71
HDAC4 P56524 8/20 0.69
HDAC1 Q13547 8/20 0.69
HDAC7 Q8WUI4 8/20 0.69
HDAC11 Q96DB2 8/20 0.69
HDAC8 Q9BY41 8/20 0.69
HDAC6 Q9UBN7 8/20 0.69
HDAC9 Q9UKV0 8/20 0.69
HDAC5 Q9UQL6 8/20 0.69
HDAC3 O15379 7/20 0.69
HDAC2 Q92769 7/20 0.69
HDAC10 Q969S8 7/20 0.69
CYP3A4 P08684 2/20 0.68
KDM4E B2RXH2 1/20 0.68
BRD4 O60885 1/20 0.68
NCOR1 O75376 1/20 0.68
NR1I2 O75469 1/20 0.68

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
SCHEMBL94252 0.93 L3MBTL1 (0.89) L3MBTL1MAPTHTTSMN1; SMN2HDAC4
SCHEMBL12112926 0.91 MAPT (0.79) L3MBTL1MAPTHTTSMN1; SMN2HDAC4
SCHEMBL517309 0.91 HDAC4 (0.81) HDAC4HDAC1HDAC7HDAC11HDAC8
SCHEMBL6296181 0.91 HDAC4 (0.75) L3MBTL1MAPTHTTHDAC4HDAC1
SCHEMBL13010739 0.89 L3MBTL1 (0.67) L3MBTL1MAPTHTTSMN1; SMN2HDAC4
SCHEMBL14966662 0.89 L3MBTL1 (1.00) L3MBTL1MAPTHTTSMN1; SMN2HDAC4
SCHEMBL8974891 0.89 L3MBTL1 (0.67) L3MBTL1MAPTHTTSMN1; SMN2HDAC4
SCHEMBL22786946 0.89 L3MBTL1 (0.67) L3MBTL1MAPTHTTSMN1; SMN2HDAC4
Benzophenone SCHEMBL8650084 0.89 ALDH1A1 (0.68) L3MBTL1MAPTHTTSMN1; SMN2HDAC4
SCHEMBL3353284 0.89 L3MBTL1 (0.72) L3MBTL1MAPTHTTSMN1; SMN2HDAC4

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1453789-A2 N,N'-SUBSTITUTED-1,3-DIAMINO-2-HYDROXYPROPANE DERIVATIVES Elan Pharmaceuticals, Inc. (US) 2004-09-08 EP claimed
WO-2003040096-A2 N, N'-SUBSTITUTED-1,3-DIAMINO-2-HYDROXYPROPANE DERIVATIVES ELAN PHARMACEUTICALS, INC. (US) 2003-05-15 WO claimed
WO-2019005563-A1 METHODS RELATED TO ACTIVATION OF THE BONE MORPHOGENIC PROTEIN SIGNALING PATHWAY ST. JUDE CHILDREN'S RESEARCH HOSPITAL (US) 2019-01-03 WO disclosed
US-20170189277-A1 COMPOSITE PIGMENT AND METHOD FOR PREPARATION THEREOF L'OREAL (FR) 2017-07-06 US disclosed
US-20150190320-A1 COSMETIC COMPOSITION COMPRISING COMPOSITE SUNSCREEN PARTICLES L'OREAL (FR) 2015-07-09 US disclosed
US-20150157539-A1 COSMETIC COMPOSITION COMPRISING COMPOSITE PARTICLES L'OREAL (FR) 2015-06-11 US disclosed
US-8882902-B2 Composite pigment and method for preparation thereof L'OREAL (FR) 2014-11-11 US disclosed
US-20130309285-A1 COMPOSITE PIGMENT AND METHOD FOR PREPARATION THEREOF L'OREAL (FR) 2013-11-21 US disclosed
US-20130259912-A1 COMPOSITE PIGMENT AND METHOD FOR PREPARATION THEREOF L'OREAL (FR) 2013-10-03 US disclosed
CN-102985494-A Dye compositions and dye synthesis GE HEALTHCARE AS 2013-03-20 CN disclosed
US-20100162416-A1 Multi-stage stem cell carcinogenesis STEMLIFELINE, INC. (US) 2010-06-24 US disclosed
EP-0468648-B1 Anionic bis(hydroxynaphthylamino) disazo dyestuffs and use thereof for ink jet printing ZENECA LTD (GB) 1995-09-20 EP disclosed
US-5262527-A Disazo dyes suitable for use in ink jet printing IMPERIAL CHEMICAL INDUSTRIES PLC (GB) 1993-11-16 US disclosed
EP-0557721-A2 Crystalline polypropylene resin composition and amide compounds NEW JAPAN CHEMICAL CO.,LTD. (JP) 1993-09-01 EP disclosed
EP-0155194-B2 THERMOPLASTIC RESIN COMPOSITIONS HAVING IMPROVED MOLDABILITY MITSUBISHI PETROCHEMICAL CO., LTD. (JP) 1993-07-07 EP disclosed
US-5106919-A Acrylic polymers of acids or esters imidized by an N-aryl amide, sulfonamide or urea; high glass transition temperatures MOUNTEDIPE S.R.L. (IT) 1992-04-21 US disclosed
EP-0382167-A1 Process for preparation of compatible mixtures of N-aryl polyglutarimides with styrene copolymers ENICHEM S.p.A. (IT) 1990-08-16 EP disclosed
EP-0155194-B1 THERMOPLASTIC RESIN COMPOSITIONS HAVING IMPROVED MOLDABILITY MITSUBISHI PETROCHEMICAL CO., LTD. (JP) 1989-06-07 EP disclosed
US-4684684-A HEAT RESISTANCE MITSUBISHI PETROCHEMICAL CO., LTD. (JP) 1987-08-04 US disclosed
EP-0155194-A2 Thermoplastic resin compositions having improved moldability MITSUBISHI PETROCHEMICAL CO., LTD. (JP) 1985-09-18 EP 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 (5 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-20170189277-A1 COMPOSITE PIGMENT AND METHOD FOR PREPARATION THEREOF TYR, RAB5IF, MITF L3MBTL1 4529/4885MAPT 1171/4885HTT 410/4885
US-20130259912-A1 COMPOSITE PIGMENT AND METHOD FOR PREPARATION THEREOF TYR, MITF, PUF60 L3MBTL1 4482/4885MAPT 825/4885HTT 415/4885
US-20150157539-A1 COSMETIC COMPOSITION COMPRISING COMPOSITE PARTICLES MITF, RAB5IF, TYR L3MBTL1 4562/4885MAPT 922/4885HTT 652/4885
US-20130309285-A1 COMPOSITE PIGMENT AND METHOD FOR PREPARATION THEREOF TYR, RAB5IF, MITF L3MBTL1 4529/4885MAPT 1171/4885HTT 410/4885
US-20150190320-A1 COSMETIC COMPOSITION COMPRISING COMPOSITE SUNSCREEN PARTICLES XPA, ERCC1, ERCC4 L3MBTL1 4246/4885MAPT 2352/4885HTT 512/4885

“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.