SCHEMBL18138306

SCHEMBL18138306

COc1cc(OC)c(Cl)c(N(C(=O)OC(C)(C)C)C(=O)N(Cc2ccccc2)c2cc(Nc3nn(C)cc3N=O)ncn2)c1Cl

nearest known ligand 0.44

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ FGFR4 P22455 7/20 0.44
▸ FGFR1 P11362 11/20 0.40
▸ FGFR3 P22607 8/20 0.38
▸ FGFR2 P21802 4/20 0.38
▸ EGFR P00533 1/20 0.38
▸ CYP3A4 P08684 3/20 0.38
▸ CYP2C19 P33261 3/20 0.38
▸ CYP1A2 P05177 1/20 0.36
▸ LCK P06239 3/20 0.34
▸ JAK2 O60674 2/20 0.34
▸ ABL1 P00519 2/20 0.34
▸ INSR P06213 2/20 0.34
▸ FYN P06241 2/20 0.34
▸ YES1 P07947 2/20 0.34
▸ LYN P07948 2/20 0.34
▸ RET P07949 2/20 0.34
▸ MET P08581 2/20 0.34
▸ ROS1 P08922 2/20 0.34
▸ KIT P10721 2/20 0.34
▸ SRC P12931 2/20 0.34

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
SCHEMBL18138305 0.86 FGFR4 (0.36) FGFR4FGFR1FGFR3FGFR2EGFR
SCHEMBL18138355 0.83 FGFR4 (0.62) FGFR4FGFR1FGFR3FGFR2EGFR
SCHEMBL18138307 0.82 FGFR4 (0.43) FGFR4FGFR1FGFR3FGFR2EGFR
SCHEMBL18138303 0.80 FGFR4 (0.37) FGFR4FGFR1FGFR3FGFR2EGFR
SCHEMBL18138308 0.77 FGFR4 (0.50) FGFR4FGFR1FGFR3FGFR2EGFR
SCHEMBL18131226 0.71 FGFR4 (0.62) FGFR4FGFR1FGFR3FGFR2EGFR
SCHEMBL18131198 0.70 FGFR4 (0.79) FGFR4FGFR1FGFR3FGFR2EGFR
SCHEMBL18138353 0.69 FGFR4 (0.34) FGFR4FGFR1FGFR3FGFR2EGFR
SCHEMBL17728857 0.68 FGFR4 (0.43) FGFR4FGFR1FGFR3FGFR2CYP3A4
SCHEMBL23665610 0.66 FGFR4 (0.38) FGFR4FGFR1FGFR3FGFR2CYP3A4

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-2016164754-A1 FGFR4 INHIBITORS EISAI R&D MANAGEMENT CO., LTD. (JP) 2016-10-13 — — WO disclosed
Send feedback