SCHEMBL1919904

SCHEMBL1919904

COc1ccc([C@@H]2CN(c3ccc(=O)n(C)n3)C[C@H]2C(=O)O)c(F)c1

nearest known ligand 0.45

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
MC4R P32245 6/20 0.45
KDM4E B2RXH2 1/20 0.42
STAT3 P40763 1/20 0.42
FPR1 P21462 3/20 0.37
FPR2 P25090 3/20 0.37
CPS1 P31327 5/20 0.36
MC3R P41968 3/20 0.36
MC5R P33032 1/20 0.36
KCNH2 Q12809 1/20 0.36
HCRTR1 O43613 1/20 0.36
HCRTR2 O43614 1/20 0.36
DPP4 P27487 3/20 0.35
DPP7 Q9UHL4 1/20 0.35
MAPT P10636 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
SCHEMBL1945989 0.91 MC4R (0.43) MC4RKDM4ESTAT3FPR1FPR2
SCHEMBL3262709 0.88 MC4R (0.52) MC4RMC3RMC5RKCNH2
SCHEMBL13493164 0.88 MC4R (0.52) MC4RMC3RMC5RKCNH2
SCHEMBL15039514 0.83 KDM4E (0.39) MC4RKDM4ESTAT3FPR1FPR2
SCHEMBL1945992 0.82 KDM4E (0.43) MC4RKDM4ESTAT3FPR1FPR2
SCHEMBL1919957 0.81 MC4R (0.49) MC4RMC3RMC5RKCNH2
SCHEMBL12536952 0.80 PANK3 (0.45) MC4RMC3RDPP4
SCHEMBL1921096 0.79 MC4R (0.55) MC4RMC3RMC5RKCNH2HCRTR1
SCHEMBL15016246 0.79 MC4R (0.55) MC4RMC3RMC5RKCNH2HCRTR1
SCHEMBL15016245 0.79 MC4R (0.55) MC4RMC3RMC5RKCNH2HCRTR1

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 7 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8592403-B2 Diazepine and diazocane compounds as MC4 agonists PFIZER LIMITED (GB) 2013-11-26 US disclosed
EP-2326638-B9 DIAZEPINE AND DIAZOCANE COMPOUNDS AS MC4 AGONISTS PFIZER LTD (GB) 2013-11-13 EP disclosed
EP-2326638-B1 DIAZEPINE AND DIAZOCANE COMPOUNDS AS MC4 AGONISTS PFIZER LTD (GB) 2013-06-19 EP disclosed
US-20110136814-A1 Diazepine and Diazocane Compounds As MC4 Agonists ANDREWS MARK DAVID 2011-06-09 US disclosed
US-20110136814-A1 Diazepine and Diazocane Compounds As MC4 Agonists ANDREWS MARK DAVID 2011-06-09 US disclosed
EP-2326638-A1 DIAZEPINE AND DIAZOCANE COMPOUNDS AS MC4 AGONISTS Pfizer Limited (GB) 2011-06-01 EP disclosed
WO-2010015972-A1 DIAZEPINE AND DIAZOCANE COMPOUNDS AS MC4 AGONISTS PFIZER LIMITED (GB) 2010-02-11 WO 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 (1 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-20110136814-A1 Diazepine and Diazocane Compounds As MC4 Agonists MC4R, CHRM4, GPR4 MC4R 1/4885KDM4E 804/4885STAT3 4055/4885

“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.