SCHEMBL25716804

SCHEMBL25716804

C=C(F)C(=O)Nc1cc(C)c(-c2ccc3[nH]nc(N)c3c2-c2ccc(Oc3nccc(C)n3)c(F)c2)cn1

nearest known ligand 0.48

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ FGFR1 P11362 3/20 0.48
▸ FGFR2 P21802 2/20 0.48
▸ FGFR4 P22455 2/20 0.48
▸ FGFR3 P22607 2/20 0.48
▸ CYP3A4 P08684 1/20 0.48
▸ CYP2D6 P10635 1/20 0.48
▸ CYP2C9 P11712 1/20 0.48
▸ CYP2C19 P33261 1/20 0.48
▸ ALOX5AP P20292 4/20 0.42
▸ FEN1 P39748 4/20 0.42
▸ KDR P35968 14/20 0.39
▸ FLT3 P36888 7/20 0.39
▸ KIT P10721 6/20 0.39
▸ FLT1 P17948 6/20 0.39
▸ FLT4 P35916 6/20 0.39
▸ CSF1R P07333 5/20 0.39
▸ LYN P07948 5/20 0.39
▸ SRC P12931 5/20 0.39
▸ BLK P51451 5/20 0.39
▸ LCK P06239 4/20 0.39

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
SCHEMBL25716405 0.90 CYP3A4 (0.45) FGFR1FGFR2FGFR4FGFR3CYP3A4
SCHEMBL25715301 0.81 KDR (0.38) FGFR1FGFR2FGFR4FGFR3CYP3A4
SCHEMBL25716455 0.80 EGFR (0.39) FGFR1FGFR2FGFR4FGFR3CYP3A4
SCHEMBL25718413 0.73 ALOX5AP (0.41) FGFR1FGFR2FGFR4FGFR3CYP3A4
SCHEMBL24772971 0.72 FGFR1 (0.64) FGFR1FGFR2FGFR4FGFR3CYP3A4
SCHEMBL24773385 0.71 FGFR1 (0.57) FGFR1FGFR2FGFR4FGFR3CYP3A4
SCHEMBL25715151 0.70 BTK (0.40) FGFR1KDRFLT3KITFLT1
SCHEMBL31083384 0.70 FGFR1 (0.68) FGFR1FGFR2FGFR4FGFR3CYP3A4
SCHEMBL31129025 0.70 FGFR1 (0.53) FGFR1FGFR2FGFR4FGFR3CYP3A4
SCHEMBL24772724 0.70 CYP3A4 (0.56) FGFR1FGFR2FGFR4FGFR3CYP3A4

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-2023104035-A1 SUBSTITUTED MONOCYCLIC OR BICYCLIC HETEROCYCLIC COMPOUND, PREPARATION METHOD THEREFOR AND MEDICAL USE THEREOF 英矽智能科技(上海)有限公司 2023-06-15 — — WO disclosed
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