SCHEMBL17849714

SCHEMBL17849714

N#Cc1cnc2c(NC3CC3)cc(Nc3ccc(NC4CCOCC4)c(-n4cnnc4)c3)nn12

nearest known ligand 0.48

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
▸ CSNK2A2 P19784 17/20 0.48
▸ TYK2 P29597 3/20 0.41
▸ STAT3 P40763 1/20 0.41
▸ CSNK2A1 P68400 3/20 0.40
▸ CLK1 P49759 1/20 0.39
▸ CLK2 P49760 1/20 0.39
▸ CDK7 P50613 1/20 0.39
▸ PHKG1 Q16816 1/20 0.39
▸ HIPK4 Q8NE63 1/20 0.39
▸ CLK4 Q9HAZ1 1/20 0.39
▸ DAPK2 Q9UIK4 1/20 0.39

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
SCHEMBL2358177 0.89 CSNK2A2 (0.62) CSNK2A2TYK2STAT3CSNK2A1
SCHEMBL2356315 0.87 CSNK2A2 (0.59) CSNK2A2TYK2STAT3CSNK2A1CLK1
SCHEMBL3312315 0.87 CSNK2A2 (0.46) CSNK2A2TYK2STAT3CSNK2A1CLK1
SCHEMBL12013318 0.87 CSNK2A2 (0.46) CSNK2A2TYK2STAT3CSNK2A1CLK1
SCHEMBL3313753 0.87 CSNK2A2 (0.39) CSNK2A2TYK2STAT3CSNK2A1
SCHEMBL3313421 0.85 CSNK2A2 (0.43) CSNK2A2TYK2STAT3CSNK2A1CLK1
SCHEMBL3311734 0.84 CSNK2A2 (0.48) CSNK2A2CSNK2A1CLK1CLK2CDK7
SCHEMBL3311067 0.84 CSNK2A2 (0.65) CSNK2A2TYK2CSNK2A1CLK1CLK2
SCHEMBL3313209 0.84 CSNK2A2 (0.53) CSNK2A2CSNK2A1CLK1CLK2CDK7
SCHEMBL3312928 0.83 CSNK2A2 (0.49) CSNK2A2TYK2CSNK2A1CLK1CLK2

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
US-9371328-B2 Imidazopyridazinecarbonitriles useful as kinase inhibitors BRISTOL-MYERS SQUIBB COMPANY (US) 2016-06-21 — — US disclosed
US-9371328-B2 Imidazopyridazinecarbonitriles useful as kinase inhibitors BRISTOL-MYERS SQUIBB COMPANY (US) 2016-06-21 — — US disclosed
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