SCHEMBL8683090

SCHEMBL8683090

CCC(Cc1ccc(C)cc1)N(c1nc(-c2ccc(Cl)cc2Cl)c(C)s1)C1CC1

nearest known ligand 0.41

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
CRHR1 P34998 10/20 0.38
OPRL1 P41146 1/20 0.35
KMT2A Q03164 1/20 0.35
DPP4 P27487 1/20 0.35

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
SCHEMBL8681643 0.93 CRHR1 (0.37) CRHR1OPRL1KMT2A
SCHEMBL8682531 0.93 CRHR1 (0.37) CRHR1OPRL1KMT2A
SCHEMBL8687476 0.89 CRHR1 (0.34) CRHR1OPRL1KMT2A
SCHEMBL8684079 0.87 CDC7 (0.44) KMT2A
SCHEMBL8686216 0.87 CDC7 (0.39) CRHR1KMT2A
SCHEMBL8681813 0.87 DHODH (0.39) CRHR1KMT2A
Hydrochloric Acid SCHEMBL8683853 0.86 CDC7 (0.38) CRHR1KMT2A
SCHEMBL8681814 0.83 CDC7 (0.36) CRHR1KMT2A
SCHEMBL8683102 0.78 CRHR1 (0.40) CRHR1OPRL1KMT2ADPP4
SCHEMBL8681725 0.75 CRHR1 (0.38) CRHR1KMT2ADPP4

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
US-5821255-A REGULATING THE SECRETION OF CORTICOTROPIN, BETA-ENDORPHIN OR PEPTIDES DERIVED FROM PROOPIOMELANOCORTIN SANOFI (FR) 1998-10-13 US disclosed