SCHEMBL2008409

SCHEMBL2008409

O=C(O)C1(c2cccc3ccccc23)CCCN1O

nearest known ligand 0.43

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
SLC6A3 Q01959 9/20 0.39
SLC6A4 P31645 7/20 0.39
SLC6A2 P23975 6/20 0.39
CXCR5 P32302 1/20 0.37
AVPR1A P37288 1/20 0.37
LMNA P02545 1/20 0.37
POLB P06746 1/20 0.37
NR4A1 P22736 1/20 0.37
NR4A2 P43354 1/20 0.37
NR4A3 Q92570 1/20 0.37
KDM4E B2RXH2 1/20 0.36
TAAR1 Q96RJ0 1/20 0.36
AKR1C1 Q04828 1/20 0.36
GAA P10253 1/20 0.35

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
SCHEMBL2494142 0.82 SLC6A3 (0.40) SLC6A3SLC6A4SLC6A2CXCR5AVPR1A
SCHEMBL2899070 0.77 AKR1C1 (0.47) SLC6A3SLC6A4SLC6A2LMNAAKR1C1
Benzene SCHEMBL27670886 0.77 AKR1C1 (0.47) SLC6A3SLC6A4SLC6A2LMNAAKR1C1
SCHEMBL20446611 0.75 SLC6A3 (0.40) SLC6A3SLC6A4SLC6A2LMNAPOLB
SCHEMBL8112531 0.73 AKR1C1 (0.52) SLC6A3SLC6A4SLC6A2CXCR5NR4A1
SCHEMBL697151 0.72 AKR1C1 (0.48) SLC6A3SLC6A4SLC6A2CXCR5NR4A1
SCHEMBL21722268 0.67 SLC6A4 (0.43) SLC6A3SLC6A4SLC6A2CXCR5LMNA
SCHEMBL11014788 0.67 SLC6A3 (0.40) SLC6A3SLC6A4SLC6A2CXCR5NR4A1
SCHEMBL6231574 0.66 SLC6A3 (0.44) SLC6A3SLC6A4SLC6A2AVPR1AKDM4E
SCHEMBL8106448 0.66 SLC6A3 (0.45) SLC6A3SLC6A4SLC6A2NR4A1NR4A2

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 SLC6A3 529/4885SLC6A4 980/4885SLC6A2 357/4885
US-20040167201-A1 Pyrrolidine melanocortin-specific compounds MC3R, MC1R, MC5R SLC6A3 123/4885SLC6A4 310/4885SLC6A2 262/4885
US-20040157264-A1 Piperazine melanocortin-specific compounds MC1R, MC5R, MC3R SLC6A3 246/4885SLC6A4 507/4885SLC6A2 425/4885
US-20090076029-A1 Compounds and Methods for Treating Obesity MC4R, MC3R, MC1R SLC6A3 349/4885SLC6A4 463/4885SLC6A2 449/4885
US-20070155670-A1 Pyrrolidine Melanocortin-Specific Compounds MC3R, MC1R, MC5R SLC6A3 108/4885SLC6A4 204/4885SLC6A2 205/4885
US-20090253713-A1 Small Molecule Compositions for Sexual Dysfunction PDE3B, PDE3A, PDE5A SLC6A3 94/4885SLC6A4 393/4885SLC6A2 153/4885
US-20050124636-A1 Thieno [2,3-D]pyrimidine-2,4-dione melanocortin-specific compounds MC1R, MC5R, MC4R SLC6A3 236/4885SLC6A4 374/4885SLC6A2 304/4885
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 SLC6A3 526/4885SLC6A4 570/4885SLC6A2 428/4885

“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.