SCHEMBL21600911

SCHEMBL21600911

C=CC(=O)Nc1cc(N2CCN(CC)CC2)ccc1Nc1cc(NC2CCOCC2)c(C#N)cn1

nearest known ligand 0.50

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
▸ FGFR4 P22455 9/20 0.50
▸ FGFR1 P11362 9/20 0.48
▸ FGFR3 P22607 3/20 0.47
▸ FGFR2 P21802 2/20 0.47
▸ MAPK3 P27361 4/20 0.46
▸ MAPK1 P28482 3/20 0.46
▸ MAPK10 P53779 1/20 0.45
▸ JAK3 P52333 1/20 0.40

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
SCHEMBL21600912 0.93 FGFR4 (0.51) FGFR4FGFR1FGFR3FGFR2MAPK3
SCHEMBL21596399 0.93 FGFR4 (0.51) FGFR4FGFR1FGFR3FGFR2MAPK3
SCHEMBL30379371 0.93 FGFR4 (0.51) FGFR4FGFR1FGFR3FGFR2MAPK3
SCHEMBL21600903 0.88 FGFR4 (0.50) FGFR4FGFR1FGFR3FGFR2MAPK3
SCHEMBL21601052 0.87 FGFR4 (0.54) FGFR4FGFR1FGFR3FGFR2MAPK3
SCHEMBL21600890 0.85 FGFR1 (0.49) FGFR4FGFR1FGFR3FGFR2MAPK3
SCHEMBL21600891 0.85 FGFR1 (0.49) FGFR4FGFR1FGFR3FGFR2MAPK3
SCHEMBL21600958 0.85 JAK3 (0.49) FGFR4FGFR1FGFR2MAPK3JAK3
SCHEMBL21600957 0.85 FGFR1 (0.49) FGFR4FGFR1FGFR3FGFR2MAPK3
SCHEMBL21600886 0.84 FGFR4 (0.53) FGFR4FGFR1FGFR3FGFR2MAPK3

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-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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