SCHEMBL28569207

SCHEMBL28569207

[CH2]c1nn(C(C)C)c(=O)n(-c2ccc(F)cc2)c1=O

nearest known ligand 0.39

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
MET P08581 8/20 0.39
AXL P30530 5/20 0.39
GSK3A P49840 1/20 0.39
GSK3B P49841 1/20 0.39
ALDH1A1 P00352 2/20 0.38
TSHR P16473 1/20 0.38
MAPK1 P28482 1/20 0.38
HSD17B10 Q99714 1/20 0.37
POLB P06746 2/20 0.36
TYRO3 Q06418 2/20 0.36
MERTK Q12866 2/20 0.36
KDM4E B2RXH2 2/20 0.34
TDP1 Q9NUW8 1/20 0.34
L3MBTL1 Q9Y468 1/20 0.34
NPC1 O15118 1/20 0.34
CYP2C19 P33261 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
SCHEMBL21785519 0.84 MET (0.40) METAXLGSK3AGSK3BALDH1A1
SCHEMBL24878816 0.82 MET (0.39) METAXLGSK3AGSK3BALDH1A1
SCHEMBL21785556 0.80 ALDH1A1 (0.39) METAXLGSK3AGSK3BALDH1A1
SCHEMBL14969120 0.79 MET (0.48) METAXLALDH1A1POLBTYRO3
SCHEMBL29814284 0.78 MET (0.47) METAXLALDH1A1POLBTYRO3
SCHEMBL23071277 0.74 POLB (0.41) METAXLPOLBTYRO3MERTK
SCHEMBL14969155 0.73 NPC1 (0.51) METAXLALDH1A1POLBTYRO3
SCHEMBL18186597 0.72 POLB (0.44) METAXLPOLBTYRO3MERTK
SCHEMBL21785516 0.69 AXL (0.38) METAXLALDH1A1TSHRHSD17B10
SCHEMBL24878818 0.69 POLB (0.36) METAXLGSK3AGSK3BALDH1A1

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-112930215-A Pyrazolo [3, 4-b ] pyridine compounds as TAM and MET kinase inhibitors 阿雷生物药品公司 2021-06-08 CN disclosed