SCHEMBL13421374

SCHEMBL13421374

COCCNc1cc(Nc2cc(N)cc(F)c2)nn2c(N)cnc12

nearest known ligand 0.41

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
▸ TYK2 P29597 15/20 0.41
▸ PDE4D Q08499 8/20 0.39
▸ FYN P06241 2/20 0.37
▸ MKNK1 Q9BUB5 1/20 0.37
▸ CCNE1 P24864 1/20 0.32
▸ CDK2 P24941 1/20 0.32
▸ FLT3 P36888 1/20 0.32
▸ ALDH1A1 P00352 1/20 0.32
▸ MAPT P10636 1/20 0.32
▸ KCNH3 Q9ULD8 1/20 0.32

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
SCHEMBL13421759 0.88 TYK2 (0.41) TYK2PDE4DFYNMKNK1CCNE1
SCHEMBL13422017 0.87 TYK2 (0.40) TYK2PDE4DFYNMKNK1
SCHEMBL13421368 0.83 TYK2 (0.41) TYK2PDE4DCCNE1CDK2FLT3
SCHEMBL13421386 0.80 TYK2 (0.39) TYK2PDE4DFYNMKNK1CCNE1
SCHEMBL13421313 0.78 TYK2 (0.61) TYK2PDE4DCCNE1CDK2FLT3
SCHEMBL13421346 0.78 TYK2 (0.40) TYK2PDE4DCCNE1CDK2FLT3
SCHEMBL13422007 0.78 TYK2 (0.52) TYK2PDE4D
SCHEMBL13421911 0.78 FYN (0.35) TYK2PDE4DFYNMKNK1CCNE1
SCHEMBL13421554 0.78 TYK2 (0.36) TYK2PDE4DFYNMKNK1CCNE1
SCHEMBL3314987 0.77 CSNK2A2 (0.39) TYK2PDE4DFYNMKNK1

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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