SCHEMBL4700838

SCHEMBL4700838

CC(C)(C)OC(=O)NC(Cc1ccc(Cl)cc1)C(=O)N1CCC(c2ccccc2N(CCN2C(=O)c3ccccc3C2=O)S(C)(=O)=O)CC1

nearest known ligand 0.48

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
MC4R P32245 13/20 0.47
KMT2A Q03164 2/20 0.44
MAPK1 P28482 1/20 0.42
TACR1 P25103 1/20 0.41
HRH2 P25021 1/20 0.40
HRH1 P35367 1/20 0.40
PABPC1 P11940 1/20 0.40

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
SCHEMBL4700334 1.00 MC4R (0.47) MC4RKMT2AMAPK1TACR1HRH2
SCHEMBL6328428 0.87 MC4R (0.47) MC4RMAPK1TACR1
SCHEMBL4700072 0.87 MC4R (0.59) MC4R
SCHEMBL4697730 0.84 MC4R (0.44) MC4RTACR1
Hydrochloric Acid SCHEMBL4676307 0.84 MC4R (0.43) MC4RTACR1
SCHEMBL4703607 0.83 MC4R (0.47) MC4RTACR1
SCHEMBL4701631 0.81 BRD4 (0.43) MC4RMAPK1
SCHEMBL4698174 0.80 TACR1 (0.53) MC4RKMT2AMAPK1TACR1HRH2
SCHEMBL4701517 0.77 MC4R (0.65) MC4R
SCHEMBL4699053 0.76 KMT2A (0.53) MC4RKMT2AMAPK1HRH2HRH1

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 1 patent. 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