SCHEMBL20094249

SCHEMBL20094249

CNC(=O)c1cc(COc2cnc(Nc3c(C)cccc3N)nc2)c(Cl)c(OC)c1

nearest known ligand 0.53

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
▸ FGFR4 P22455 20/20 0.53
▸ FGFR1 P11362 5/20 0.51
▸ FGFR2 P21802 3/20 0.47
▸ FGFR3 P22607 3/20 0.47
▸ CYP3A4 P08684 1/20 0.44
▸ CYP2D6 P10635 1/20 0.44
▸ CYP2C9 P11712 1/20 0.44
▸ CYP2C19 P33261 1/20 0.44

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
SCHEMBL20094121 0.85 FGFR4 (0.74) FGFR4FGFR1FGFR2FGFR3CYP3A4
SCHEMBL21386642 0.80 FGFR4 (0.68) FGFR4FGFR1FGFR2FGFR3CYP3A4
SCHEMBL20094071 0.79 FGFR4 (0.73) FGFR4FGFR1FGFR2FGFR3CYP3A4
SCHEMBL20093899 0.78 FGFR4 (0.48) FGFR4FGFR1FGFR2FGFR3CYP3A4
SCHEMBL16070501 0.78 FGFR4 (0.45) FGFR4FGFR1FGFR2FGFR3
SCHEMBL16070240 0.78 FGFR4 (0.44) FGFR4FGFR1FGFR2FGFR3
SCHEMBL20094092 0.77 FGFR4 (0.69) FGFR4FGFR1FGFR2FGFR3CYP3A4
SCHEMBL16070185 0.77 FGFR4 (0.44) FGFR4FGFR1FGFR2FGFR3
SCHEMBL16069924 0.76 FGFR4 (0.44) FGFR4FGFR1FGFR2FGFR3
SCHEMBL16070188 0.76 FGFR4 (0.43) FGFR4FGFR1FGFR2FGFR3

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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