SCHEMBL4699796

SCHEMBL4699796

Cc1cc(C)c(S(=O)(=O)Nc2ccccc2C2CCN(C(=O)[C@@H](Cc3ccc(Cl)cc3)NC(=O)[C@@H]3Cc4ccccc4CN3C(=O)O)CC2)c(C)c1

nearest known ligand 0.40

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
TACR1 P25103 1/20 0.40
MC4R P32245 10/20 0.39
MC5R P33032 4/20 0.39
MC3R P41968 4/20 0.39
MC1R Q01726 4/20 0.39
CYP51A1 Q16850 3/20 0.38
PYGL P06737 1/20 0.38
CCR1 P32246 2/20 0.38
CYP3A4 P08684 1/20 0.37

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
SCHEMBL4699883 0.92 MCL1 (0.41) TACR1MC4RMC5RMC3RMC1R
SCHEMBL4700944 0.85 MC4R (0.39) TACR1MC4RMC5RMC3RMC1R
SCHEMBL4697989 0.85 MC4R (0.54) MC4RMC5RMC3RMC1R
SCHEMBL4754436 0.84 MC4R (0.43) TACR1MC4RMC5RMC3RMC1R
SCHEMBL4700243 0.84 MC4R (0.44) TACR1MC4RMC5RMC3RMC1R
SCHEMBL4701820 0.83 MC4R (0.41) TACR1MC4RMC5RMC3RMC1R
SCHEMBL4703222 0.83 TACR1 (0.57) TACR1MC4R
SCHEMBL4697991 0.83 MC4R (0.41) TACR1MC4RMC5RMC3RMC1R
SCHEMBL4698168 0.82 MC4R (0.45) TACR1MC4RMC5RMC3RMC1R
SCHEMBL4700877 0.82 MC4R (0.43) TACR1MC4RMC5RMC3RMC1R

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 TACR1 48/4885MC4R 1/4885MC5R 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.