SCHEMBL5797396

SCHEMBL5797396

Cc1ccccc1-n1nc(CC(=O)c2ccc(F)cc2Cl)ccc1=O

nearest known ligand 0.47

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
MAPK14 Q16539 9/20 0.47
MAPK11 Q15759 9/20 0.47
MAPK13 O15264 5/20 0.47
MAPK12 P53778 4/20 0.47
P2RX7 Q99572 9/20 0.47
CYP2C9 P11712 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
SCHEMBL4239808 0.89 MAPK11 (0.46) MAPK14MAPK11MAPK13MAPK12P2RX7
SCHEMBL4240705 0.82 LMNA (0.47) MAPK14MAPK11MAPK13MAPK12CYP2C9
SCHEMBL5796462 0.78 MAPK14 (0.46) MAPK14MAPK11MAPK13MAPK12P2RX7
SCHEMBL5798754 0.78 PIM1 (0.40) MAPK14MAPK11MAPK13MAPK12CYP2C9
SCHEMBL4236899 0.69 MAPK11 (0.44) MAPK14MAPK11MAPK13MAPK12P2RX7
SCHEMBL5796374 0.68 AKR1B1 (0.46) P2RX7
SCHEMBL3097093 0.67 SMN1; SMN2 (0.49)
SCHEMBL18781471 0.67 MAPK14 (0.52) MAPK14MAPK11MAPK13MAPK12
SCHEMBL5799285 0.67 MAPK11 (0.63) MAPK14MAPK11MAPK13MAPK12P2RX7
SCHEMBL4247801 0.67 MAPK11 (0.42) MAPK14MAPK11MAPK13MAPK12P2RX7

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