SCHEMBL8566256

SCHEMBL8566256

CSc1ccc(-c2nc3c(C(C)=O)cccn3c2-c2ccc(F)cc2)cc1

nearest known ligand 0.46

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
PTGS1 P23219 3/20 0.46
PTGS2 P35354 3/20 0.46
MAPK13 O15264 4/20 0.45
MAPK12 P53778 4/20 0.45
MAPK11 Q15759 4/20 0.45
MAPK14 Q16539 4/20 0.45
GCGR P47871 2/20 0.45
GRIA1 P42261 6/20 0.43
AKT1 P31749 4/20 0.43
AKT2 P31751 4/20 0.43
CSNK1E P49674 2/20 0.41
CCNA2 P20248 1/20 0.41
CDK2 P24941 1/20 0.41
CDK5 Q00535 1/20 0.41
CDK5R1 Q15078 1/20 0.41
KDM4E B2RXH2 1/20 0.40
ALDH1A1 P00352 1/20 0.40
HPGD P15428 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
SCHEMBL13743031 0.87 GRIA1 (0.45) PTGS1PTGS2GRIA1AKT1AKT2
SCHEMBL13866614 0.84 AKT1 (0.42) PTGS1PTGS2GRIA1AKT1AKT2
SCHEMBL213843 0.83 PTGS2 (0.58) PTGS1PTGS2GRIA1AKT1AKT2
SCHEMBL13751999 0.81 AKT1 (0.43) PTGS1PTGS2GRIA1AKT1AKT2
SCHEMBL213844 0.77 PTGS2 (0.43) PTGS1PTGS2GRIA1AKT1AKT2
SCHEMBL8564136 0.75 ALDH1A1 (0.53) PTGS1PTGS2MAPK13MAPK12MAPK11
SCHEMBL6102319 0.73 MAPT (0.53) PTGS1PTGS2MAPK13MAPK12MAPK11
SCHEMBL8566547 0.72 AKT1 (0.55) PTGS1PTGS2AKT1AKT2
SCHEMBL8566479 0.71 PTGS2 (0.56) PTGS1PTGS2
SCHEMBL5266214 0.70 MAPK14 (0.54) PTGS1PTGS2MAPK13MAPK12MAPK11

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
EP-0819127-A1 IMIDAZO [1,2-a]PYRIDINE DERIVATIVES GLAXO GROUP LIMITED (GB) 1998-01-21 EP disclosed
WO-1996031509-A1 IMIDAZO[1,2-a]PYRIDINE DERIVATIVES GLAXO GROUP LIMITED (GB) 1996-10-10 WO disclosed