SCHEMBL11996471

SCHEMBL11996471

COCCNc1cc(Nc2ccc(C)c(NC(=O)O)c2)nn2c(C#N)cnc12

nearest known ligand 0.40

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
▸ MAPK14 Q16539 4/20 0.40
▸ FGFR4 P22455 11/20 0.40
▸ CSNK2A2 P19784 3/20 0.38
▸ CSNK2A1 P68400 2/20 0.38
▸ HIPK2 Q9H2X6 2/20 0.38
▸ HIPK1 Q86Z02 1/20 0.38
▸ DYRK2 Q92630 1/20 0.38
▸ HIPK3 Q9H422 1/20 0.38
▸ STK17A Q9UEE5 1/20 0.38
▸ TYK2 P29597 1/20 0.38
▸ KCNH2 Q12809 2/20 0.38
▸ DYRK3 O43781 1/20 0.38
▸ CDK2 P24941 1/20 0.38
▸ GSK3B P49841 1/20 0.38
▸ CSNK2B P67870 1/20 0.38
▸ PIM3 Q86V86 1/20 0.38

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
SCHEMBL12012940 0.94 MAPK14 (0.41) MAPK14FGFR4CSNK2A2CSNK2A1HIPK2
SCHEMBL3310314 0.94 KCNH2 (0.44) MAPK14FGFR4CSNK2A2CSNK2A1HIPK2
SCHEMBL3313469 0.87 CSNK2A2 (0.42) FGFR4CSNK2A2CSNK2A1TYK2
SCHEMBL3311369 0.86 TYK2 (0.40) MAPK14FGFR4CSNK2A2TYK2
SCHEMBL3311742 0.84 CSNK2A1 (0.46) MAPK14CSNK2A2CSNK2A1HIPK2HIPK1
SCHEMBL13644218 0.82 CSNK2A2 (0.41) FGFR4CSNK2A2TYK2
SCHEMBL3309971 0.82 CSNK2A2 (0.42) MAPK14CSNK2A2CSNK2A1HIPK2HIPK1
SCHEMBL3313776 0.82 CSNK2A2 (0.53) CSNK2A2CSNK2A1HIPK2HIPK1DYRK2
SCHEMBL13421552 0.81 MAPK14 (0.42) MAPK14TYK2
SCHEMBL13421530 0.81 TYK2 (0.41) MAPK14CSNK2A2CSNK2A1HIPK2TYK2

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-8252795-B2 Imidazopyridazinecarbonitriles useful as kinase inhibitors BRISTOL-MYERS SQUIBB COMPANY (US) 2012-08-28 — — US claimed
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