SCHEMBL18131695

SCHEMBL18131695

C=CC(=O)Nc1cc(N2CCOCC2)cc(C)c1Nc1ncc(C#Cc2c(F)c(OC)cc(OC)c2F)cn1

nearest known ligand 0.60

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
▸ FGFR4 P22455 9/20 0.60
▸ FGFR1 P11362 8/20 0.60
▸ FGFR3 P22607 1/20 0.48
▸ CYP3A4 P08684 1/20 0.48
▸ CYP2D6 P10635 1/20 0.48
▸ CYP2C9 P11712 1/20 0.48
▸ CYP2C19 P33261 1/20 0.48
▸ SRC P12931 1/20 0.44
▸ EGFR P00533 7/20 0.44
▸ BTK Q06187 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
SCHEMBL18131815 0.90 FGFR4 (0.75) FGFR4FGFR1FGFR3CYP3A4CYP2D6
SCHEMBL18131774 0.85 FGFR4 (0.82) FGFR4FGFR1FGFR3CYP3A4CYP2D6
SCHEMBL18134024 0.83 FGFR1 (0.39) FGFR4FGFR1
SCHEMBL18131708 0.82 MAPT (0.39) FGFR4FGFR1CYP2C9CYP2C19
SCHEMBL18131836 0.81 FGFR4 (0.81) FGFR4FGFR1FGFR3CYP3A4CYP2D6
SCHEMBL18131804 0.75 FGFR4 (1.00) FGFR4FGFR1FGFR3CYP3A4CYP2D6
SCHEMBL15434044 0.74 FGFR1 (1.00) FGFR4FGFR1FGFR3CYP3A4CYP2D6
SCHEMBL18131735 0.73 FGFR4 (0.70) FGFR4FGFR1FGFR3CYP3A4CYP2D6
SCHEMBL20094372 0.72 FGFR1 (0.59) FGFR4FGFR1FGFR3
SCHEMBL18134032 0.72 FGFR1 (0.52) FGFR4FGFR1FGFR3

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