SCHEMBL5811997

SCHEMBL5811997

CCNc1[nH]nc(-c2ccc(F)cc2Cl)c1-c1ccc(=O)n(-c2ccccc2C)n1

nearest known ligand 0.57

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
MAPK11 Q15759 13/20 0.57
MAPK14 Q16539 13/20 0.57
MAPK13 O15264 8/20 0.57
MAPK12 P53778 7/20 0.57
CYP2C9 P11712 1/20 0.43
TP53 P04637 3/20 0.35
MEN1 O00255 2/20 0.35
KMT2A Q03164 2/20 0.35
P2RX7 Q99572 1/20 0.34
FGFR1 P11362 1/20 0.34
FGFR2 P21802 1/20 0.34
FGFR3 P22607 1/20 0.34

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
SCHEMBL5812295 0.87 MAPK13 (0.53) MAPK11MAPK14MAPK13MAPK12CYP2C9
SCHEMBL5807295 0.82 MAPK11 (0.44) MAPK11MAPK14MAPK13MAPK12CYP2C9
SCHEMBL5808593 0.82 MAPK11 (0.44) MAPK11MAPK14MAPK13MAPK12CYP2C9
SCHEMBL4243757 0.82 MAPK11 (0.51) MAPK11MAPK14MAPK13MAPK12CYP2C9
SCHEMBL4245632 0.82 MAPK11 (0.51) MAPK11MAPK14MAPK13MAPK12CYP2C9
SCHEMBL5806925 0.82 MAPK11 (0.51) MAPK11MAPK14MAPK13MAPK12CYP2C9
SCHEMBL4241190 0.79 MAPK11 (0.49) MAPK11MAPK14MAPK13MAPK12CYP2C9
SCHEMBL4243488 0.79 MAPK11 (0.50) MAPK11MAPK14MAPK13MAPK12CYP2C9
SCHEMBL4239796 0.79 MAPK11 (0.46) MAPK11MAPK14MAPK13MAPK12CYP2C9
SCHEMBL4239955 0.78 MAPK11 (0.51) MAPK11MAPK14MAPK13MAPK12CYP2C9

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
WO-2006038734-A1 PYRIDAZINONE DERIVATIVES CYTOKINES INHIBITORS ASTELLAS PHARMA INC. (JP) 2006-04-13 WO disclosed