SCHEMBL22149092

SCHEMBL22149092

Cn1nc(C2CC2)c(C(=O)c2ccc3nccc(Oc4c(Cl)cccc4Cl)c3c2)c1O

nearest known ligand 0.39

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
MGLL Q99685 4/20 0.39
DOT1L Q8TEK3 2/20 0.37
MAPK8 P45983 2/20 0.36
KDR P35968 7/20 0.35
TGFBR1 P36897 5/20 0.35
DDR2 Q16832 1/20 0.34
MET P08581 1/20 0.34
AXL P30530 1/20 0.34
MERTK Q12866 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
SCHEMBL22149002 0.92 MGLL (0.41) MGLLDOT1LKDRTGFBR1DDR2
SCHEMBL22149093 0.89 MGLL (0.39) MGLLKDRTGFBR1DDR2MET
SCHEMBL22148992 0.88 DOT1L (0.40) MGLLDOT1LKDRTGFBR1DDR2
SCHEMBL22149084 0.88 MGLL (0.37) MGLLKDRMETAXLMERTK
SCHEMBL22149103 0.86 TGFBR1 (0.38) MGLLKDRTGFBR1DDR2MET
SCHEMBL22149058 0.85 MGLL (0.39) MGLLTGFBR1METAXLMERTK
SCHEMBL22149065 0.84 MET (0.49) MGLLKDRDDR2METAXL
SCHEMBL22149061 0.83 GPBAR1 (0.37) MGLLKDRTGFBR1METAXL
SCHEMBL22149094 0.82 PDGFRA (0.41) MGLLKDRMETAXLMERTK
SCHEMBL22148987 0.81 MGLL (0.41) MGLL

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-2020124515-A1 QUINOLINE DERIVATIVE, PREPARATION METHOD AND USE THEREOF 东莞市东阳光农药研发有限公司 2020-06-25 WO disclosed