SCHEMBL20525535

SCHEMBL20525535

COc1ccc(CNC(=O)C(=O)Nc2ccc(Oc3ccnc4c(OC)c(OCC5CCN(C)CC5)ccc34)c(F)c2)cc1

nearest known ligand 0.51

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
MET P08581 13/20 0.51
KDR P35968 6/20 0.42
PDE4A P27815 2/20 0.42
PDE4B Q07343 2/20 0.42
PDE4C Q08493 2/20 0.42
PDE4D Q08499 2/20 0.42
FLT3 P36888 1/20 0.41
IGF1R P08069 3/20 0.41
AXL P30530 1/20 0.40

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
SCHEMBL20525821 0.94 MET (0.54) METKDRFLT3IGF1R
SCHEMBL20525671 0.93 MET (0.48) METKDRFLT3
SCHEMBL20525650 0.91 MET (0.49) METKDRPDE4APDE4BPDE4C
SCHEMBL20525673 0.89 MET (0.49) METKDRFLT3IGF1RAXL
SCHEMBL20525800 0.88 MET (0.51) METKDRFLT3AXL
SCHEMBL20525607 0.88 MET (0.58) METKDRFLT3IGF1RAXL
SCHEMBL371776 0.88 MET (0.66) METKDRFLT3AXL
SCHEMBL20525606 0.88 MET (0.50) METKDRFLT3AXL
SCHEMBL20525632 0.86 MET (0.53) METKDRFLT3AXL
SCHEMBL20525653 0.86 MET (0.48) METKDRFLT3AXL

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-2101759-B1 METHODS OF USING MEK INHIBITORS EXELIXIS INC (US) 2018-10-10 EP claimed