SCHEMBL13926830

SCHEMBL13926830

COCCNCc1ccc(-c2cc3nccc(Oc4ccc(NC(=S)NC(=O)Cc5ccc(F)cc5)c(C)c4)c3s2)nc1

nearest known ligand 0.75

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MET P08581 18/20 0.75
KDR P35968 18/20 0.75
MST1R Q04912 3/20 0.75
AXL P30530 2/20 0.75
FLT3 P36888 2/20 0.75
PLK4 O00444 1/20 0.75
MAP4K4 O95819 1/20 0.75
ABL1 P00519 1/20 0.75
LCK P06239 1/20 0.75
FYN P06241 1/20 0.75
LYN P07948 1/20 0.75
HCK P08631 1/20 0.75
PDGFRB P09619 1/20 0.75
BCR P11274 1/20 0.75
SRC P12931 1/20 0.75
ABL2 P42684 1/20 0.75
FRK P42685 1/20 0.75
SYK P43405 1/20 0.75
DDR1 Q08345 1/20 0.75
MERTK Q12866 1/20 0.75

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
SCHEMBL104760 0.94 MET (0.78) METKDRMST1RAXLFLT3
SCHEMBL2670902 0.94 MET (0.75) METKDRMST1RAXLFLT3
Glesatinib SCHEMBL106319 0.86 MET (1.00) METKDRMST1RAXLFLT3
Glesatinib SCHEMBL29351360 0.86 MET (1.00) METKDRMST1RAXLFLT3
SCHEMBL2670909 0.85 MET (0.70) METKDRMST1RAXLFLT3
SCHEMBL104761 0.85 MET (0.69) METKDRMST1RAXLFLT3
SCHEMBL13167449 0.83 MET (0.91) METKDRMST1RAXLFLT3
SCHEMBL2670515 0.82 MET (0.89) METKDRMST1RAXLFLT3
SCHEMBL103919 0.82 MET (0.61) METKDRMST1RAXLFLT3
SCHEMBL2673548 0.81 MET (0.91) METKDRMST1RAXLFLT3

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-2009026717-A1 INHIBITORS OF PROTEIN TYROSINE KINASE ACTIVITY METHYLGENE INC. (CA) 2009-03-05 WO disclosed