SCHEMBL20525527

SCHEMBL20525527

COc1ccc(Br)cc1CCNC(=O)C(=O)Nc1ccc(Oc2ccnc3c(OC)c(OCC4CCNCC4)ccc23)c(F)c1

nearest known ligand 0.47

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
MET P08581 11/20 0.47
FLT3 P36888 3/20 0.41
MC4R P32245 1/20 0.39
AXL P30530 3/20 0.38
KDR P35968 3/20 0.37
EGFR P00533 1/20 0.37
FGFR1 P11362 1/20 0.37
FLT1 P17948 1/20 0.37
FLT4 P35916 1/20 0.37
MERTK Q12866 1/20 0.37

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
SCHEMBL20525624 0.93 MET (0.49) METFLT3AXLKDR
SCHEMBL20525756 0.92 MET (0.47) METFLT3AXLKDREGFR
SCHEMBL20525743 0.92 MET (0.51) METFLT3AXLKDR
SCHEMBL20525853 0.91 MET (0.48) METFLT3AXLKDR
SCHEMBL20525730 0.90 MET (0.47) METFLT3AXLKDR
SCHEMBL20525793 0.90 MET (0.50) METFLT3KDR
SCHEMBL20525761 0.90 MET (0.47) METFLT3AXLKDREGFR
SCHEMBL20525840 0.89 MET (0.49) METFLT3KDR
SCHEMBL371701 0.89 MET (0.60) METFLT3AXLKDREGFR
SCHEMBL20525636 0.89 MET (0.50) METFLT3AXLKDREGFR

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