SCHEMBL20525673

SCHEMBL20525673

COc1c(OCC2CCN(C)CC2)ccc2c(Oc3ccc(NC(=O)C(=O)NCCc4ccc(F)cc4)cc3F)ccnc12

nearest known ligand 0.49

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MET P08581 15/20 0.49
KDR P35968 4/20 0.45
AXL P30530 3/20 0.43
TDP1 Q9NUW8 1/20 0.42
EGFR P00533 2/20 0.41
FLT3 P36888 3/20 0.41
PDGFRB P09619 2/20 0.41
KIT P10721 2/20 0.41
PDGFRA P16234 2/20 0.41
FLT1 P17948 2/20 0.41
MST1R Q04912 2/20 0.41
MERTK Q12866 2/20 0.41
PLK4 O00444 1/20 0.41
STK25 O00506 1/20 0.41
CIT O14578 1/20 0.41
AURKA O14965 1/20 0.41
CHUK O15111 1/20 0.41
MUSK O15146 1/20 0.41
EPHB6 O15197 1/20 0.41
MAPK13 O15264 1/20 0.41

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
SCHEMBL20525684 0.91 MET (0.47) METKDRAXLTDP1EGFR
SCHEMBL20525632 0.91 MET (0.53) METKDRAXLEGFRFLT3
SCHEMBL20525535 0.89 MET (0.51) METKDRAXLFLT3IGF1R
SCHEMBL20525606 0.89 MET (0.50) METKDRAXLFLT3
SCHEMBL20525821 0.88 MET (0.54) METKDRFLT3IGF1R
SCHEMBL20525800 0.88 MET (0.51) METKDRAXLEGFRFLT3
SCHEMBL20525607 0.88 MET (0.58) METKDRAXLFLT3IGF1R
SCHEMBL371696 0.88 MET (0.64) METKDRAXLEGFRFLT3
SCHEMBL20525823 0.88 POLB (0.47) METKDRAXLIGF1R
SCHEMBL20525671 0.87 MET (0.48) METKDRFLT3BRAF

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