SCHEMBL14280867

SCHEMBL14280867

Cc1ccc(Cc2nnc3cc(-c4ccc(Cl)cc4)c(-c4ccccc4Cl)nn3c2=O)cc1

nearest known ligand 0.41

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
CNR1 P21554 12/20 0.41
ALDH1A1 P00352 1/20 0.40
CNR2 P34972 9/20 0.39
SMN1; SMN2 Q16637 1/20 0.38
ARF6 P62330 1/20 0.37
GRM5 P41594 1/20 0.37
KDM4E B2RXH2 1/20 0.37
HPGD P15428 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
SCHEMBL4886271 0.87 ARF6 (0.43) CNR1CNR2ARF6
SCHEMBL3551780 0.82 MET (0.41) CNR1ALDH1A1CNR2KDM4E
SCHEMBL3557048 0.78 ALOX5 (0.45) CNR1ALDH1A1CNR2ARF6KDM4E
SCHEMBL4872815 0.78 CNR1 (0.43) CNR1CNR2
SCHEMBL3552117 0.76 CNR1 (0.43) CNR1ALDH1A1CNR2KDM4E
SCHEMBL3556439 0.75 CNR1 (0.40) CNR1CNR2ARF6
SCHEMBL3555218 0.73 TP53 (0.45) CNR1ALDH1A1CNR2SMN1; SMN2KDM4E
SCHEMBL13593105 0.73 MAT2A (0.41) CNR1CNR2SMN1; SMN2KDM4E
SCHEMBL5819094 0.72 DPP4 (0.43) CNR1ALDH1A1CNR2SMN1; SMN2KDM4E
SCHEMBL4872806 0.72 CNR1 (0.41) CNR1CNR2

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-7317012-B2 Bicyclic heterocycles as cannabinoind-1 receptor modulators BRISTOL-MYERS SQUIBB COMPANY (US) 2008-01-08 US disclosed