SCHEMBL5320666

SCHEMBL5320666

CSc1ccc(-c2c(-c3ccc(F)cc3)nc3ncc(-c4cc(Cl)cc(Cl)c4)cn23)cc1

nearest known ligand 0.43

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPK14 Q16539 12/20 0.43
MAPK13 O15264 10/20 0.43
MAPK12 P53778 10/20 0.43
MAPK11 Q15759 10/20 0.43
GCGR P47871 4/20 0.43
AKT1 P31749 2/20 0.40
AKT2 P31751 2/20 0.40
PTGS1 P23219 2/20 0.37
PTGS2 P35354 2/20 0.37
GRM5 P41594 3/20 0.37
PRKD3 O94806 1/20 0.35
MAP4K4 O95819 1/20 0.35
LCK P06239 1/20 0.35
RET P07949 1/20 0.35
ALOX5 P09917 1/20 0.35
PRKACA P17612 1/20 0.35
RPS6KB1 P23443 1/20 0.35
MATK P42679 1/20 0.35
FRK P42685 1/20 0.35
MAPK9 P45984 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
SCHEMBL5342012 0.83 AKT1 (0.44) AKT1AKT2PTGS1PTGS2MAPT
SCHEMBL5344560 0.81 MAPK14 (0.42) MAPK14MAPK13MAPK12MAPK11GCGR
SCHEMBL5320129 0.79 AKT1 (0.46) MAPK14MAPK13MAPK12MAPK11AKT1
SCHEMBL5347682 0.78 GRM5 (0.39) AKT1AKT2GRM5
SCHEMBL5319387 0.78 AKT1 (0.41) MAPK14AKT1AKT2PTGS1PTGS2
SCHEMBL5354165 0.78 AKT1 (0.44) MAPK14MAPK13MAPK12MAPK11AKT1
SCHEMBL5341386 0.75 AKT1 (0.49) AKT1AKT2PTGS2GRM5GSK3B
SCHEMBL5324372 0.75 AKT1 (0.55) AKT1AKT2PTGS2GRM5MAPT
SCHEMBL5321674 0.75 AKT1 (0.45) MAPK14MAPK13MAPK12MAPK11AKT1
SCHEMBL6102319 0.74 MAPT (0.53) MAPK14MAPK13MAPK12MAPK11GCGR

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 2 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2007096764-A2 BICYCLIC HETEROARYL DERIVATIVES AS CANNABINOID RECEPTOR MODULATORS GLENMARK PHARMACEUTICALS S.A. (US) 2007-08-30 WO claimed
WO-2007096764-A2 BICYCLIC HETEROARYL DERIVATIVES AS CANNABINOID RECEPTOR MODULATORS GLENMARK PHARMACEUTICALS S.A. (US) 2007-08-30 WO disclosed