SCHEMBL18134023

SCHEMBL18134023

COc1cc(OC)c(F)c(C#Cc2cnc(Nc3c(C)cccc3N)nc2)c1F

nearest known ligand 0.51

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
▸ FGFR4 P22455 12/20 0.51
▸ FGFR1 P11362 4/20 0.42
▸ CYP3A4 P08684 1/20 0.42
▸ CYP2D6 P10635 1/20 0.42
▸ CYP2C9 P11712 1/20 0.42
▸ CYP2C19 P33261 1/20 0.42
▸ FGFR2 P21802 1/20 0.35
▸ FGFR3 P22607 1/20 0.35
▸ MAP4K1 Q92918 1/20 0.33

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
SCHEMBL15434003 0.87 FGFR4 (0.65) FGFR4FGFR1CYP3A4CYP2D6CYP2C9
SCHEMBL18131690 0.84 FGFR4 (0.50) FGFR4FGFR1CYP3A4CYP2D6CYP2C9
SCHEMBL15434004 0.81 FGFR4 (0.62) FGFR4
SCHEMBL18131836 0.79 FGFR4 (0.81) FGFR4FGFR1CYP3A4CYP2D6CYP2C9
SCHEMBL18133990 0.79 FGFR3 (0.50) FGFR4FGFR1CYP3A4CYP2D6CYP2C9
SCHEMBL21386622 0.79 FGFR4 (0.65) FGFR4FGFR1CYP3A4CYP2D6CYP2C9
SCHEMBL18134024 0.77 FGFR1 (0.39) FGFR4FGFR1
SCHEMBL18134032 0.76 FGFR1 (0.52) FGFR4FGFR1FGFR2FGFR3
SCHEMBL15244317 0.75 PDGFRB (0.35) —
SCHEMBL15725730 0.73 KDR (0.35) —

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-2016164703-A1 FGFR4 INHIBITORS EISAI R & D MANAGEMENT CO., LTD. (JP) 2016-10-13 — — WO disclosed
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