SCHEMBL20093934

SCHEMBL20093934

C=CC(=O)Nc1cccc(C)c1Nc1ncc(OCc2c(F)c(OC)cc(OC)c2Cl)cn1

nearest known ligand 0.89

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
▸ FGFR4 P22455 20/20 0.89
▸ FGFR1 P11362 6/20 0.89
▸ CYP3A4 P08684 1/20 0.89
▸ CYP2D6 P10635 1/20 0.89
▸ CYP2C9 P11712 1/20 0.89
▸ CYP2C19 P33261 1/20 0.89
▸ FGFR2 P21802 3/20 0.79
▸ FGFR3 P22607 3/20 0.79

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
SCHEMBL18131723 0.94 FGFR4 (1.00) FGFR4FGFR1CYP3A4CYP2D6CYP2C9
SCHEMBL18131722 0.94 FGFR4 (1.00) FGFR4FGFR1CYP3A4CYP2D6CYP2C9
SCHEMBL18131831 0.88 FGFR4 (0.84) FGFR4FGFR1CYP3A4CYP2D6CYP2C9
SCHEMBL20094112 0.88 FGFR4 (1.00) FGFR4FGFR1CYP3A4CYP2D6CYP2C9
SCHEMBL18131746 0.88 FGFR4 (0.84) FGFR4FGFR1CYP3A4CYP2D6CYP2C9
SCHEMBL18131734 0.87 FGFR4 (0.87) FGFR4FGFR1CYP3A4CYP2D6CYP2C9
SCHEMBL20094096 0.87 FGFR4 (1.00) FGFR4FGFR1CYP3A4CYP2D6CYP2C9
SCHEMBL20094042 0.87 FGFR4 (1.00) FGFR4FGFR1FGFR2FGFR3
SCHEMBL18131721 0.87 FGFR4 (0.85) FGFR4FGFR1CYP3A4CYP2D6CYP2C9
SCHEMBL20094002 0.85 FGFR4 (0.80) FGFR4FGFR1CYP3A4CYP2D6CYP2C9

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-2018072707-A1 AROMATIC ETHER DERIVATIVE, PREPARATION METHOD THEREFOR, AND MEDICAL APPLICATIONS THEREOF 保诺科技(北京)有限公司 2018-04-26 — — WO disclosed
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