SCHEMBL25715512

SCHEMBL25715512

COc1c(Cl)c(Br)c2c(N)ncnn12

nearest known ligand 0.34

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
▸ FGFR1 P11362 5/20 0.34
▸ FGFR3 P22607 5/20 0.34
▸ RET P07949 1/20 0.34
▸ PIK3CD O00329 5/20 0.33
▸ PIK3CA P42336 1/20 0.32
▸ PIK3CG P48736 1/20 0.32
▸ RIPK1 Q13546 3/20 0.31
▸ XDH P47989 1/20 0.31
▸ ACVRL1 P37023 1/20 0.30

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
SCHEMBL25715804 0.79 PIK3CD (0.31) FGFR1FGFR3PIK3CDXDHACVRL1
SCHEMBL27993999 0.75 ACVRL1 (0.33) FGFR1FGFR3PIK3CDXDHACVRL1
SCHEMBL25714215 0.71 FGFR1 (0.34) FGFR1FGFR3RETPIK3CDPIK3CA
SCHEMBL25714865 0.70 PIK3CD (0.39) FGFR1FGFR3PIK3CDXDHACVRL1
SCHEMBL28098635 0.70 PLK4 (0.32) FGFR1FGFR3PIK3CDPIK3CAPIK3CG
SCHEMBL279494 0.69 FGFR1 (0.37) FGFR1FGFR3RETPIK3CDXDH
SCHEMBL279456 0.69 FGFR1 (0.34) FGFR1FGFR3RETPIK3CDXDH
SCHEMBL22315380 0.69 FGFR1 (0.39) FGFR1FGFR3PIK3CDACVRL1
SCHEMBL25715807 0.68 ACVRL1 (0.34) FGFR1FGFR3PIK3CDACVRL1
SCHEMBL19280583 0.66 PIK3CD (0.39) RETPIK3CDPIK3CAPIK3CGACVRL1

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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