SCHEMBL1935940

SCHEMBL1935940

COCCN(C(=O)O)C(C)c1cnc(-c2cc3nccc(Oc4ccc(NC(=O)NC(C)C)cc4F)c3s2)n1C

nearest known ligand 0.47

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MET P08581 19/20 0.47
KDR P35968 18/20 0.47
MST1R Q04912 8/20 0.47
AXL P30530 2/20 0.46
FLT3 P36888 2/20 0.46
NTRK1 P04629 1/20 0.46
KIT P10721 1/20 0.46
NTRK2 Q16620 1/20 0.46
PLK4 O00444 1/20 0.44
MAP4K4 O95819 1/20 0.44
ABL1 P00519 1/20 0.44
LCK P06239 1/20 0.44
FYN P06241 1/20 0.44
LYN P07948 1/20 0.44
HCK P08631 1/20 0.44
PDGFRB P09619 1/20 0.44
BCR P11274 1/20 0.44
SRC P12931 1/20 0.44
ABL2 P42684 1/20 0.44
FRK P42685 1/20 0.44

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
SCHEMBL1479209 0.92 MET (0.48) METKDRMST1RAXLFLT3
SCHEMBL1674647 0.88 MST1R (0.47) METKDRMST1RAXLFLT3
SCHEMBL12807225 0.86 MET (0.46) METKDRMST1RAXLFLT3
SCHEMBL2596153 0.85 MST1R (0.47) METKDRMST1RAXLFLT3
SCHEMBL2535013 0.85 MST1R (0.47) METKDRMST1RAXLFLT3
SCHEMBL1935941 0.85 MST1R (0.50) METKDRMST1RAXLFLT3
SCHEMBL1479907 0.84 MET (0.55) METKDRMST1RAXLFLT3
SCHEMBL1478646 0.83 MET (0.47) METKDRMST1RAXLFLT3
SCHEMBL2533021 0.83 MST1R (0.47) METKDRMST1RAXLFLT3
SCHEMBL1481551 0.83 PDGFRA (0.49) 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
EP-2332536-A1 Inhibitors of protein tyrosine kinase activity MethylGene Inc. (CA) 2011-06-15 EP disclosed