SCHEMBL30031376

SCHEMBL30031376

CCOc1ccn(-c2cccc(F)c2)c(=O)c1C(=O)Cl

nearest known ligand 0.44

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
AXL P30530 4/20 0.43
MET P08581 4/20 0.42
MST1R Q04912 3/20 0.42
PLK4 O00444 1/20 0.42
ABL1 P00519 1/20 0.42
NTRK1 P04629 1/20 0.42
LCK P06239 1/20 0.42
RET P07949 1/20 0.42
KIT P10721 1/20 0.42
PDGFRA P16234 1/20 0.42
PRKACA P17612 1/20 0.42
KDR P35968 1/20 0.42
FLT3 P36888 1/20 0.42
ABL2 P42684 1/20 0.42
FRK P42685 1/20 0.42
TYRO3 Q06418 1/20 0.42
DDR1 Q08345 1/20 0.42
PDE4D Q08499 1/20 0.42
MAP4K2 Q12851 1/20 0.42
MERTK Q12866 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
SCHEMBL23749466 1.00 AXL (0.43) AXLMETMST1RPLK4ABL1
SCHEMBL21383448 0.89 AXL (0.43) AXLMETMST1RPLK4ABL1
SCHEMBL30031367 0.88 MET (0.43) AXLMETMST1RPLK4ABL1
SCHEMBL2592272 0.85 MET (0.51) AXLMETMST1RPLK4ABL1
SCHEMBL23749279 0.81 MET (0.42) AXLMETMST1RPLK4ABL1
SCHEMBL23749324 0.79 MET (0.41) AXLMETMST1RPLK4ABL1
SCHEMBL23749393 0.79 MET (0.43) AXLMETMST1RPLK4ABL1
SCHEMBL23749427 0.79 PTGS1 (0.39) AXLMETMST1RPLK4ABL1
SCHEMBL21382863 0.75 KDM4E (0.48) ALDH1A1MEN1KMT2A
SCHEMBL15506038 0.75 GLA (0.43) AXLMETMST1RPLK4ABL1

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-111196814-B Aromatic ring-linked dioxane quinazoline or quinoline compound, composition and application thereof 北京赛特明强医药科技有限公司 2022-12-06 CN disclosed