SCHEMBL21600886

SCHEMBL21600886

C=CC(=O)Nc1cc(N2CCN(CC)CC2)ccc1Nc1cc(Nc2ccccc2)c(C#N)cn1

nearest known ligand 0.53

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
▸ FGFR4 P22455 8/20 0.53
▸ FGFR1 P11362 10/20 0.53
▸ FGFR2 P21802 2/20 0.49
▸ FGFR3 P22607 2/20 0.49
▸ EGFR P00533 2/20 0.46
▸ JAK3 P52333 2/20 0.46
▸ BTK Q06187 1/20 0.46
▸ CTSC P53634 1/20 0.44
▸ MAPK10 P53779 1/20 0.44
▸ MAP3K7 O43318 1/20 0.42
▸ SRC P12931 1/20 0.42
▸ MAPK1 P28482 1/20 0.42
▸ MAP2K1 Q02750 1/20 0.42
▸ MAPK3 P27361 1/20 0.42

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
SCHEMBL21600974 0.91 CTSC (0.52) FGFR1EGFRJAK3BTKCTSC
SCHEMBL21596386 0.91 FGFR1 (0.50) FGFR4FGFR1FGFR2FGFR3EGFR
SCHEMBL21601052 0.90 FGFR4 (0.54) FGFR4FGFR1FGFR2FGFR3EGFR
SCHEMBL23581181 0.87 FGFR4 (0.52) FGFR4FGFR1FGFR2FGFR3EGFR
SCHEMBL21600884 0.87 MAPK10 (0.45) FGFR4FGFR1FGFR2FGFR3EGFR
SCHEMBL21600893 0.87 FGFR1 (0.49) FGFR4FGFR1FGFR2FGFR3EGFR
SCHEMBL21600947 0.87 FGFR4 (0.48) FGFR4FGFR1FGFR2FGFR3EGFR
SCHEMBL21596334 0.86 FGFR1 (0.50) FGFR4FGFR1FGFR2FGFR3EGFR
SCHEMBL21600961 0.85 FGFR1 (0.49) FGFR4FGFR1FGFR2FGFR3JAK3
SCHEMBL21596399 0.85 FGFR4 (0.51) FGFR4FGFR1FGFR2FGFR3EGFR

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 3 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-112313207-B Cyano-substituted pyridine and cyano-substituted pyrimidine compounds, and preparation methods and applications thereof 北京赛特明强医药科技有限公司 2023-02-14 — — CN disclosed
CN-112313207-A Cyano-substituted pyridine and cyano-substituted pyrimidine compounds, and preparation methods and applications thereof 北京赛特明强医药科技有限公司 2021-02-02 — — CN disclosed
WO-2019242689-A1 CYANO-SUBSTITUTED PYRIDINE AND CYANO-SUBSTITUTED PYRIMIDINE COMPOUND, AND PREPARATION METHOD AND APPLICATION THEREOF 北京赛特明强医药科技有限公司 2019-12-26 — — WO disclosed
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