SCHEMBL29693448

SCHEMBL29693448

COc1cc2nccc(Oc3c(F)cc(NC(=O)C4(C(=O)Nc5ccc(F)cc5)CC4)cc3F)c2cc1OC

nearest known ligand 0.83

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
AXL P30530 13/20 0.83
MET P08581 10/20 0.83
KDR P35968 4/20 0.83
MERTK Q12866 5/20 0.81
FLT1 P17948 3/20 0.81
AURKB Q96GD4 3/20 0.81
RET P07949 2/20 0.81
KIT P10721 2/20 0.81
FLT3 P36888 2/20 0.81
AURKA O14965 1/20 0.81
RIPK2 O43353 1/20 0.81
ABCB11 O95342 1/20 0.81
ABL1 P00519 1/20 0.81
EGFR P00533 1/20 0.81
ERBB2 P04626 1/20 0.81
NTRK1 P04629 1/20 0.81
LCK P06239 1/20 0.81
PGR P06401 1/20 0.81
LYN P07948 1/20 0.81
CHRM2 P08172 1/20 0.81

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
SCHEMBL372199 1.00 AXL (0.83) AXLMETKDRMERTKFLT1
SCHEMBL19373328 0.94 AXL (0.73) AXLMETKDRMERTKFLT1
SCHEMBL19372985 0.92 AXL (0.71) AXLMETKDRMERTKFLT1
SCHEMBL5141878 0.91 AXL (0.76) AXLMETKDRMERTKFLT1
Exelixis SCHEMBL371899 0.91 MET (1.00) AXLMETKDRMERTKFLT1
Exelixis SCHEMBL29693473 0.91 MET (1.00) AXLMETKDRMERTKFLT1
SCHEMBL29693417 0.90 AXL (0.75) AXLMETKDRMERTKFLT1
SCHEMBL371824 0.90 AXL (0.75) AXLMETKDRMERTKFLT1
SCHEMBL15338455 0.90 AXL (0.68) AXLMETKDRMERTKFLT1
Cabozantinib SCHEMBL29351408 0.90 AXL (1.00) AXLMETKDRMERTKFLT1

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-3329918-B1 C-MET MODULATORS AND METHODS OF USE EXELIXIS INC (US) 2022-05-25 EP claimed