SCHEMBL4699883

SCHEMBL4699883

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

nearest known ligand 0.41

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
MCL1 Q07820 3/20 0.41
MC4R P32245 8/20 0.40
MC5R P33032 5/20 0.40
MC3R P41968 5/20 0.40
MC1R Q01726 5/20 0.40
MAPK1 P28482 1/20 0.39
HDAC8 Q9BY41 1/20 0.39
CYP3A4 P08684 1/20 0.38
TACR1 P25103 1/20 0.38
KMT2A Q03164 2/20 0.38
BCL2 P10415 1/20 0.38
PTPN1 P18031 1/20 0.38

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
SCHEMBL4699796 0.92 TACR1 (0.40) MC4RMC5RMC3RMC1RCYP3A4
SCHEMBL4698359 0.88 MCL1 (0.41) MCL1MC4RMC5RMC3RMC1R
SCHEMBL4699880 0.86 MAPK1 (0.44) MCL1MC4RMC5RMC3RMC1R
SCHEMBL4701927 0.85 MC4R (0.43) MCL1MC4RMC5RMC3RMC1R
SCHEMBL4701772 0.85 MC4R (0.45) MCL1MC4RMC5RMC3RMC1R
SCHEMBL4701498 0.84 MC4R (0.46) MCL1MC4RMC5RMC3RMC1R
SCHEMBL6318950 0.84 TACR1 (0.54) MAPK1HDAC8TACR1KMT2APTPN1
SCHEMBL4699046 0.84 MAPK1 (0.43) MCL1MC4RMC5RMC3RMC1R
SCHEMBL4698437 0.83 MC4R (0.44) MCL1MC4RMC5RMC3RMC1R
SCHEMBL4704216 0.83 MAPK1 (0.45) MCL1MC4RMC5RMC3RMC1R

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 MCL1 3342/4885MC4R 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.