SCHEMBL2008405

SCHEMBL2008405

O=C(O)C1(O)CCCN1c1cccc2ccccc12

nearest known ligand 0.40

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
AVPR1A P37288 1/20 0.40
HTR1A P08908 2/20 0.39
HTR2A P28223 2/20 0.39
TSHR P16473 2/20 0.39
HSD17B10 Q99714 2/20 0.39
HTR3E A5X5Y0 1/20 0.39
HTR3B O95264 1/20 0.39
CYP1A2 P05177 1/20 0.39
CYP2D6 P10635 1/20 0.39
NCF1 P14598 1/20 0.39
NFKB1 P19838 1/20 0.39
HTR1D P28221 1/20 0.39
HTR1B P28222 1/20 0.39
HTR7 P34969 1/20 0.39
MTOR P42345 1/20 0.39
HTR3A P46098 1/20 0.39
HTR5A P47898 1/20 0.39
HTR6 P50406 1/20 0.39
HTR3D Q70Z44 1/20 0.39
HTR3C Q8WXA8 1/20 0.39

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
SCHEMBL2899064 0.77 CYP3A4 (0.40) TSHRHSD17B10CYP1A2ALDH1A1USP2
SCHEMBL604857 0.69 SLC6A3 (0.40) HTR1AHTR2ATSHRHSD17B10HTR3E
SCHEMBL604859 0.69 SLC6A3 (0.40) HTR1AHTR2ATSHRHSD17B10HTR3E
SCHEMBL2008409 0.66 SLC6A3 (0.39) AVPR1AKDM4ELMNAPOLBNR4A1
SCHEMBL5234760 0.65 USP2 (0.56) HTR1AHTR2ATSHRHSD17B10HTR3E
SCHEMBL8112531 0.64 AKR1C1 (0.52) NR4A1NR4A2NR4A3CDC25B
SCHEMBL5067826 0.64 MEN1 (0.46) TSHRCYP2D6SIGMAR1ALDH1A1KMT2A
SCHEMBL1876619 0.63 NCF1 (0.69) HTR1AHTR2ATSHRHSD17B10HTR3E
SCHEMBL569714 0.63 HTR1A (0.69) HTR1AHTR2ATSHRHSD17B10HTR3E
SCHEMBL2494142 0.63 SLC6A3 (0.40) AVPR1ASIGMAR1KDM4ELMNAPOLB

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7964601-B2 Agonist or antgonist and binders and inversion of agonist PALATIN TECHNOLOGIES, INC. (US) 2011-06-21 US disclosed
US-7732451-B2 Naphthalene-containing melanocortin receptor-specific small molecule PALATIN TECHNOLOGIES, INC. (US) 2010-06-08 US disclosed
US-7718802-B2 Agonist or antgonist and binders and inversion of agonist; use in the treatment of metabolic, immune, infection-related and melanocortin receptor mediated disorders PALATIN TECHNOLOGIES, INC. (US) 2010-05-18 US disclosed
US-7709484-B1 Substituted melanocortin receptor-specific piperazine compounds PALATIN TECHNOLOGIES, INC. (US) 2010-05-04 US disclosed
US-7655658-B2 Use of in the treatment of melanocortin receptor-associated disorders such as in treatment of anorexia, as a weight gain aid, for treatment of obesity PALATIN TECHNOLOGIES, INC. (US) 2010-02-02 US disclosed
WO-2009144432-A1 MC4-R AGONISTS FOR THE TREATMENT OF OBESITY PALATIN TECHNOLOGIES, INC. (US) 2009-12-03 WO disclosed
US-7601753-B2 Pyrrolidine melanocortin-specific compounds PALATIN TECHNOLOGIES, INC. (US) 2009-10-13 US disclosed
US-20090253713-A1 Small Molecule Compositions for Sexual Dysfunction PALATIN TECHNOLOGIES, INC. (US) 2009-10-08 US disclosed
US-7550602-B1 Small molecule compositions for sexual dysfunction PALATIN TECHNOLOGIES, INC. (US) 2009-06-23 US disclosed
US-20090076029-A1 Compounds and Methods for Treating Obesity PALATIN TECHNOLOGIES, INC. (US) 2009-03-19 US disclosed
US-20070155670-A1 Pyrrolidine Melanocortin-Specific Compounds PALATIN TECHNOLOGIES, INC. (US) 2007-07-05 US disclosed
US-7189755-B2 Pyrrolidine melanocortin-specific compounds PALATIN TECHNOLOGIES, INC. (US) 2007-03-13 US disclosed
EP-1622618-A1 MELANOCORTIN RECEPTOR-SPECIFIC COMPOUNDS Palatin Technologies, Inc. (US) 2006-02-08 EP disclosed
WO-2005102340-A1 PIPERAZINE MELANOCORTIN-SPECIFIC COMPOUNDS PALATIN TECHNOLOGIES, INC. (US) 2005-11-03 WO disclosed
US-20050176728-A1 Agonist or antgonist and binders and inversion of agonist; use in the treatment of metabolic, immune, infection-related and melanocortin receptor mediated disorders PALATIN TECHNOLOGIES, INC. (US) 2005-08-11 US disclosed
US-20050130988-A1 Naphthalene-containing melanocortin receptor-specific small molecule PALATIN TECHNOLOGIES, INC. (US) 2005-06-16 US disclosed
US-20050124636-A1 Thieno [2,3-D]pyrimidine-2,4-dione melanocortin-specific compounds PALATIN TECHNOLOGIES, INC. (US) 2005-06-09 US disclosed
WO-2004098602-A1 MELANOCORTIN RECEPTOR-SPECIFIC COMPOUNDS PALATIN TECHNOLOGIES, INC. (US) 2004-11-18 WO disclosed
US-20040167201-A1 Pyrrolidine melanocortin-specific compounds PALATIN TECHNOLOGIES, INC. (US) 2004-08-26 US disclosed
US-20040157264-A1 Piperazine melanocortin-specific compounds PALATIN TECHNOLOGIES, INC. (US) 2004-08-12 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 (8 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-20050130988-A1 Naphthalene-containing melanocortin receptor-specific small molecule MC1R, MC3R, MC2R AVPR1A 23/4885HTR1A 263/4885HTR2A 452/4885
US-20040167201-A1 Pyrrolidine melanocortin-specific compounds MC3R, MC1R, MC5R AVPR1A 18/4885HTR1A 43/4885HTR2A 70/4885
US-20040157264-A1 Piperazine melanocortin-specific compounds MC1R, MC5R, MC3R AVPR1A 45/4885HTR1A 44/4885HTR2A 26/4885
US-20090076029-A1 Compounds and Methods for Treating Obesity MC4R, MC3R, MC1R AVPR1A 166/4885HTR1A 164/4885HTR2A 186/4885
US-20070155670-A1 Pyrrolidine Melanocortin-Specific Compounds MC3R, MC1R, MC5R AVPR1A 18/4885HTR1A 61/4885HTR2A 78/4885
US-20090253713-A1 Small Molecule Compositions for Sexual Dysfunction PDE3B, PDE3A, PDE5A AVPR1A 57/4885HTR1A 862/4885HTR2A 1078/4885
US-20050124636-A1 Thieno [2,3-D]pyrimidine-2,4-dione melanocortin-specific compounds MC1R, MC5R, MC4R AVPR1A 64/4885HTR1A 47/4885HTR2A 51/4885
US-20050176728-A1 Agonist or antgonist and binders and inversion of agonist; use in the treatment of metabolic, immune, infection-related and melanocortin receptor mediated disorders MC3R, MC4R, MC1R AVPR1A 86/4885HTR1A 245/4885HTR2A 259/4885

“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.