SCHEMBL13185293

SCHEMBL13185293

COc1ccccc1CC(=O)NC(=S)Nc1ccc(Oc2ccnc3cc(-c4nccn4C)sc23)c(F)c1

nearest known ligand 0.82

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
MET P08581 20/20 0.82
KDR P35968 19/20 0.82
FLT1 P17948 1/20 0.65
FLT4 P35916 1/20 0.65
AURKA O14965 1/20 0.63
FPR1 P21462 1/20 0.63
FPR3 P25089 1/20 0.63
GPR183 P32249 1/20 0.63
SMO Q99835 1/20 0.63
GPR35 Q9HC97 1/20 0.63

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
Hydrochloric Acid SCHEMBL3568440 0.99 MET (0.81) METKDRFLT1FLT4AURKA
SCHEMBL13185292 0.94 MET (0.85) METKDRFLT1FLT4AURKA
SCHEMBL3621972 0.93 MET (0.84) METKDRFLT1FLT4AURKA
Hydrochloric Acid SCHEMBL3565404 0.93 MET (0.84) METKDRFLT1FLT4AURKA
SCHEMBL3622152 0.90 MET (0.80) METKDRFLT1FLT4AURKA
SCHEMBL3563620 0.90 MET (1.00) METKDRFLT1FLT4AURKA
SCHEMBL3616406 0.90 MET (0.79) METKDRFLT1FLT4AURKA
SCHEMBL3621597 0.89 MET (0.89) METKDRFLT1FLT4AURKA
SCHEMBL3572217 0.88 MET (0.82) METKDRAURKAFPR1FPR3
SCHEMBL3610940 0.87 MET (0.74) METKDRFLT1FLT4AURKA

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
US-7790729-B2 Inhibitors of VEGF receptor and HGF receptor signaling METHYLGENE INC. (CA) 2010-09-07 US disclosed