SCHEMBL18131702

SCHEMBL18131702

COc1cc(OC)c(F)c(COc2cnc(Nc3c(F)cccc3[N+](=O)[O-])nc2)c1F

nearest known ligand 0.55

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
▸ FGFR4 P22455 14/20 0.55
▸ FGFR1 P11362 9/20 0.55
▸ CYP3A4 P08684 1/20 0.55
▸ CYP2D6 P10635 1/20 0.55
▸ CYP2C9 P11712 1/20 0.55
▸ CYP2C19 P33261 1/20 0.55
▸ FGFR3 P22607 8/20 0.52
▸ FGFR2 P21802 3/20 0.52
▸ KCNH2 Q12809 4/20 0.46

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
SCHEMBL21386671 0.91 FGFR4 (0.64) FGFR4FGFR1CYP3A4CYP2D6CYP2C9
SCHEMBL21756495 0.80 FGFR4 (0.66) FGFR4FGFR1CYP3A4CYP2D6CYP2C9
SCHEMBL18131721 0.78 FGFR4 (0.85) FGFR4FGFR1CYP3A4CYP2D6CYP2C9
SCHEMBL18131753 0.77 FGFR4 (0.43) FGFR4FGFR1CYP3A4CYP2D6CYP2C9
SCHEMBL18131754 0.77 FGFR4 (0.43) FGFR4FGFR1CYP3A4CYP2D6CYP2C9
SCHEMBL21386622 0.76 FGFR4 (0.65) FGFR4FGFR1CYP3A4CYP2D6CYP2C9
SCHEMBL21386606 0.74 FGFR4 (0.73) FGFR4FGFR1CYP3A4CYP2D6CYP2C9
SCHEMBL18131707 0.74 FGFR4 (0.56) FGFR4FGFR1CYP3A4CYP2D6CYP2C9
SCHEMBL18131718 0.74 FGFR4 (0.41) FGFR4FGFR1CYP3A4CYP2D6CYP2C9
SCHEMBL18131810 0.74 FGFR1 (0.70) 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 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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