SCHEMBL15084689

SCHEMBL15084689

CCNc1cc(Nc2cc(-n3cn[nH]3)cc(C(F)(F)F)c2)nn2c(C#N)cnc12

nearest known ligand 0.41

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
▸ TYK2 P29597 3/20 0.41
▸ STAT3 P40763 1/20 0.41
▸ NR2E1 Q9Y466 2/20 0.32
▸ PDE4D Q08499 1/20 0.32
▸ CSNK2A2 P19784 2/20 0.32
▸ CSNK2A1 P68400 2/20 0.32
▸ ABL1 P00519 1/20 0.32
▸ BCR P11274 1/20 0.32
▸ LRRK2 Q5S007 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
SCHEMBL2357076 0.85 TYK2 (0.40) TYK2STAT3PDE4DCSNK2A2CSNK2A1
SCHEMBL13641453 0.78 TYK2 (0.53) TYK2STAT3PDE4DCSNK2A2CSNK2A1
SCHEMBL3315693 0.77 TYK2 (0.55) TYK2STAT3PDE4DCSNK2A2CSNK2A1
SCHEMBL12013157 0.75 TYK2 (0.53) TYK2STAT3PDE4DCSNK2A2CSNK2A1
SCHEMBL3313699 0.74 TYK2 (0.55) TYK2STAT3PDE4DCSNK2A2CSNK2A1
SCHEMBL2309382 0.74 TYK2 (0.56) TYK2STAT3PDE4DCSNK2A2CSNK2A1
SCHEMBL2309014 0.74 TYK2 (0.51) TYK2STAT3PDE4DCSNK2A2CSNK2A1
SCHEMBL3313575 0.73 TYK2 (0.58) TYK2STAT3CSNK2A2CSNK2A1
SCHEMBL2356721 0.72 TYK2 (0.54) TYK2STAT3PDE4DCSNK2A2CSNK2A1
SCHEMBL3312361 0.72 TYK2 (0.41) TYK2STAT3NR2E1CSNK2A2ABL1

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
EP-2350081-B1 IMIDAZOPYRIDAZINECARBONITRILES USEFUL AS KINASE INHIBITORS BRISTOL MYERS SQUIBB CO (US) 2013-07-03 — — EP disclosed
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