SCHEMBL13421554

SCHEMBL13421554

COCCNc1cc(Nc2cc(OC)cc(-n3cnnc3)c2)nn2c(N)cnc12

nearest known ligand 0.36

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
▸ TYK2 P29597 7/20 0.36
▸ CSNK2A2 P19784 1/20 0.36
▸ FYN P06241 3/20 0.33
▸ MKNK1 Q9BUB5 2/20 0.32
▸ TSHR P16473 1/20 0.32
▸ PDE4D Q08499 5/20 0.32
▸ CCNE1 P24864 1/20 0.31
▸ CDK2 P24941 1/20 0.31
▸ FLT3 P36888 1/20 0.31
▸ PRKACA P17612 1/20 0.31
▸ PRKACG P22612 1/20 0.31
▸ PRKACB P22694 1/20 0.31
▸ DYRK1A Q13627 1/20 0.30
▸ TP53 P04637 1/20 0.30
▸ KDM4E B2RXH2 1/20 0.30
▸ MAPK1 P28482 1/20 0.30
▸ HSD17B10 Q99714 1/20 0.30
▸ ROCK1 Q13464 1/20 0.30
▸ NCF1 P14598 1/20 0.30

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
SCHEMBL2357295 0.87 CSNK2A2 (0.41) TYK2CSNK2A2FYNMKNK1TSHR
SCHEMBL13421759 0.87 TYK2 (0.41) TYK2FYNMKNK1PDE4DCCNE1
SCHEMBL13421747 0.84 PRKCQ (0.41) TYK2FYNMKNK1PDE4DTP53
SCHEMBL13421386 0.79 TYK2 (0.39) TYK2CSNK2A2FYNMKNK1PDE4D
SCHEMBL13421374 0.78 TYK2 (0.41) TYK2FYNMKNK1PDE4DCCNE1
SCHEMBL13421757 0.76 CSNK2A2 (0.59) TYK2CSNK2A2PDE4DCCNE1CDK2
SCHEMBL13421753 0.76 LMNA (0.39) TYK2TSHRPDE4D
SCHEMBL13422017 0.75 TYK2 (0.40) TYK2FYNMKNK1PDE4D
SCHEMBL13421911 0.73 FYN (0.35) TYK2CSNK2A2FYNMKNK1PDE4D
SCHEMBL3313276 0.73 CSNK2A2 (0.39) TYK2CSNK2A2FYNPDE4DPRKACA

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-2010042699-A1 IMIDAZOPYRIDAZINECARBONITRILES USEFUL AS KINASE INHIBITORS BRISTOL-MYERS SQUIBB COMPANY (US) 2010-04-15 — — WO disclosed
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