SCHEMBL21602899

SCHEMBL21602899

COc1cc(OC)c(F)c(-c2cc3cnc(-c4cnn(C)c4)nc3c(N3CC(C)(O)C3)n2)c1F

nearest known ligand 0.40

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
▸ TTK P33981 7/20 0.40
▸ FGFR4 P22455 10/20 0.38
▸ FGFR1 P11362 9/20 0.38
▸ FGFR2 P21802 9/20 0.38
▸ FGFR3 P22607 9/20 0.38
▸ KDR P35968 8/20 0.38
▸ FLT3 P36888 3/20 0.38
▸ MAP4K1 Q92918 1/20 0.37
▸ VEGFA P15692 1/20 0.36
▸ FLT1 P17948 1/20 0.36
▸ PIK3CD O00329 1/20 0.34
▸ PIK3R1 P27986 1/20 0.34
▸ PLAU P00749 1/20 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
SCHEMBL21602896 0.93 TTK (0.42) TTKFGFR4FGFR1FGFR2FGFR3
SCHEMBL21602951 0.91 TTK (0.40) TTKFGFR4FGFR1FGFR2FGFR3
SCHEMBL21602967 0.87 TRPM8 (0.39) TTKFGFR4FGFR1FGFR2FGFR3
SCHEMBL21602938 0.87 TTK (0.43) TTKFGFR4FGFR1FGFR2FGFR3
SCHEMBL21602837 0.86 FGFR1 (0.38) FGFR4FGFR1FGFR2FGFR3
SCHEMBL21602893 0.85 TTK (0.48) TTKFGFR4FGFR1FGFR2FGFR3
SCHEMBL21602855 0.85 TTK (0.47) TTKFGFR4FGFR1FGFR2FGFR3
SCHEMBL21602955 0.84 ABL1 (0.39) TTKFGFR4FGFR1FGFR2FGFR3
SCHEMBL21602941 0.83 TTK (0.38) TTKFGFR4FGFR1FGFR2FGFR3
SCHEMBL21252086 0.82 JAK2 (0.38) TTKKDR

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-2019242587-A1 HIGHLY SELECTIVE FGFR I INHIBITOR, PREPARATION METHOD THEREFOR AND USE THEREOF 上海和誉生物医药科技有限公司 2019-12-26 — — WO disclosed
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