SCHEMBL4697989

SCHEMBL4697989

Cc1cc(C)c(S(=O)(=O)Nc2ccccc2C2CCN(C(=O)[C@@H](Cc3ccc(Cl)cc3)NC(=O)[C@@H]3Cc4ccccc4CN3)CC2)c(C)c1

nearest known ligand 0.54

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
MC4R P32245 19/20 0.54
SMYD3 Q9H7B4 1/20 0.42
MC5R P33032 1/20 0.41
MC3R P41968 1/20 0.41
MC1R Q01726 1/20 0.41

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
SCHEMBL6252350 0.89 MC4R (0.58) MC4RSMYD3MC5RMC3RMC1R
SCHEMBL4678742 0.89 MC4R (0.58) MC4RSMYD3MC5RMC3RMC1R
SCHEMBL4699796 0.85 TACR1 (0.40) MC4RMC5RMC3RMC1R
SCHEMBL4697991 0.85 MC4R (0.41) MC4RMC5RMC3RMC1R
SCHEMBL4697980 0.85 MC4R (0.51) MC4RSMYD3MC5RMC3RMC1R
SCHEMBL4698088 0.84 MC4R (0.60) MC4RSMYD3MC5RMC3RMC1R
SCHEMBL4697669 0.84 MC4R (0.62) MC4RSMYD3MC5RMC3RMC1R
SCHEMBL4700268 0.84 MC4R (0.54) MC4RSMYD3MC5RMC3RMC1R
SCHEMBL4697587 0.83 MC4R (0.56) MC4RSMYD3MC5RMC3RMC1R
SCHEMBL4699883 0.83 MCL1 (0.41) MC4RMC5RMC3RMC1R

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 8 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 claimed
US-6977264-B2 Substituted piperidines and methods of use AMGEN INC. (US) 2005-12-20 US claimed
US-20040006067-A1 Substituted piperidines and methods of use AMGEN INC. 2004-01-08 US claimed
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-6951849-B2 Benzimidazolidinone derivatives as muscarinic agents ACADIA PHARMACEUTICALS INC. (US) 2005-10-04 US disclosed
US-20040067931-A1 Benzimidazolidinone derivatives as muscarinic agents ACADIA PHARMACEUTICALS INC. 2004-04-08 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 (2 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-20040067931-A1 Benzimidazolidinone derivatives as muscarinic agents CHRM4, CHRM5, CHRM1 MC4R 62/4885SMYD3 1232/4885MC5R 141/4885
US-20040006067-A1 Substituted piperidines and methods of use MC4R, MC5R, MC1R MC4R 1/4885SMYD3 2928/4885MC5R 2/4885

“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.