SCHEMBL28516643

SCHEMBL28516643

COc1cc(OC)c(Cl)c(Nc2ncccc2-c2cc(Nc3ccccc3[N+](=O)[O-])ncn2)c1Cl

nearest known ligand 0.60

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
FGFR4 P22455 4/20 0.60
FGFR3 P22607 15/20 0.55
FGFR2 P21802 12/20 0.55
FGFR1 P11362 2/20 0.55
ABCG2 Q9UNQ0 1/20 0.49
MEN1 O00255 1/20 0.49
KMT2A Q03164 1/20 0.49
L3MBTL1 Q9Y468 1/20 0.49
USP2 O75604 1/20 0.42
ALDH1A1 P00352 1/20 0.42
TP53 P04637 1/20 0.42
CYP1A2 P05177 1/20 0.42
CYP3A4 P08684 1/20 0.42
MAPK1 P28482 1/20 0.42
CYP2C19 P33261 1/20 0.42
CLK4 Q9HAZ1 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
SCHEMBL28513291 0.88 FGFR4 (0.67) FGFR4FGFR3FGFR2FGFR1MEN1
SCHEMBL28512647 0.87 FGFR4 (0.58) FGFR4FGFR3FGFR2FGFR1MEN1
SCHEMBL28522513 0.87 ABCG2 (0.47) FGFR4FGFR3FGFR2FGFR1ABCG2
SCHEMBL16654477 0.85 ABCG2 (0.46) FGFR4FGFR3FGFR2FGFR1ABCG2
SCHEMBL24623013 0.84 FGFR4 (0.52) FGFR4FGFR3FGFR2FGFR1
SCHEMBL22348673 0.84 FGFR4 (0.49) FGFR4FGFR3FGFR2FGFR1
SCHEMBL30880141 0.84 FGFR4 (0.49) FGFR4FGFR3FGFR2FGFR1
SCHEMBL22348762 0.84 FGFR4 (0.49) FGFR4FGFR3FGFR2FGFR1
SCHEMBL30880149 0.84 FGFR4 (0.49) FGFR4FGFR3FGFR2FGFR1
SCHEMBL22348692 0.83 FGFR3 (0.49) FGFR4FGFR3FGFR2FGFR1

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
CN-112341431-A Heterocyclic compounds as FGFR4 inhibitors 齐鲁制药有限公司 2021-02-09 CN disclosed