SCHEMBL13167390

SCHEMBL13167390

CC(=S)Nc1ccc(Oc2ccnc3cc(-c4cn(CCN5CCCC5)cn4)sc23)c(F)c1

nearest known ligand 0.68

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
MET P08581 20/20 0.68
KDR P35968 19/20 0.68
AURKA O14965 1/20 0.56
FPR1 P21462 1/20 0.56
FPR3 P25089 1/20 0.56
GPR183 P32249 1/20 0.56
SMO Q99835 1/20 0.56
GPR35 Q9HC97 1/20 0.56

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
SCHEMBL13167393 0.90 MET (0.66) METKDR
SCHEMBL18516657 0.85 MET (0.71) METKDR
SCHEMBL18516660 0.85 MET (0.67) METKDR
SCHEMBL3621799 0.85 MET (0.81) METKDRAURKAFPR1FPR3
SCHEMBL307504 0.84 MET (0.63) METKDR
SCHEMBL10255093 0.84 MET (0.83) METKDR
SCHEMBL306466 0.83 MET (0.81) METKDR
SCHEMBL12229331 0.83 MET (0.62) METKDR
SCHEMBL10255099 0.82 MET (0.81) METKDR
SCHEMBL3625067 0.82 MET (0.68) METKDRAURKAFPR1FPR3

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