SCHEMBL4754436

SCHEMBL4754436

COC(=O)Nc1ccccc1C1CCN(C(=O)[C@@H](Cc2ccc(Cl)cc2)NC(=O)[C@@H]2Cc3ccccc3CN2C(=O)O)CC1

nearest known ligand 0.43

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
MC4R P32245 9/20 0.43
MC5R P33032 5/20 0.42
MC3R P41968 5/20 0.42
MC1R Q01726 5/20 0.42
CCR1 P32246 4/20 0.41
OPRD1 P41143 3/20 0.40
CYP3A4 P08684 1/20 0.40
TACR1 P25103 1/20 0.40
KMT2A Q03164 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
SCHEMBL4699880 0.92 MAPK1 (0.44) MC4RMC5RMC3RMC1RCYP3A4
SCHEMBL4700243 0.91 MC4R (0.44) MC4RMC5RMC3RMC1RCCR1
SCHEMBL4756442 0.90 MC4R (0.40) MC4RMC5RMC3RMC1ROPRD1
SCHEMBL4701820 0.88 MC4R (0.41) MC4RMC5RMC3RMC1RCCR1
SCHEMBL4698168 0.86 MC4R (0.45) MC4RMC5RMC3RMC1RCCR1
SCHEMBL6327800 0.86 KMT2A (0.42) MC4RMC5RMC3RMC1RCYP3A4
SCHEMBL4700892 0.86 KMT2A (0.42) MC4RMC5RMC3RMC1RCYP3A4
SCHEMBL4700877 0.86 MC4R (0.43) MC4RMC5RMC3RMC1RCCR1
SCHEMBL4700875 0.84 MC4R (0.46) MC4RMC5RMC3RMC1RCCR1
SCHEMBL4699523 0.84 RBP4 (0.45) MC4RMC5RMC3RMC1RCYP3A4

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1416933-B1 SUBSTITUTED PIPERIDINES AS MODULATORS OF THE MELANOCORTIN RECEPTOR AMGEM INC (US) 2008-01-02 EP disclosed
US-6977264-B2 Substituted piperidines and methods of use AMGEN INC. (US) 2005-12-20 US disclosed
US-20040006067-A1 Substituted piperidines and methods of use AMGEN INC. 2004-01-08 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 (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-20040006067-A1 Substituted piperidines and methods of use MC4R, MC5R, MC1R MC4R 1/4885MC5R 2/4885MC3R 4/4885

“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.