SCHEMBL20216628

SCHEMBL20216628

COc1cc2nccc(Oc3ccc(NC(=O)CCC4=CCCC=C4)cn3)c2cc1OC

nearest known ligand 0.55

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MET P08581 6/20 0.55
AXL P30530 4/20 0.49
MERTK Q12866 3/20 0.49
KDR P35968 10/20 0.48
IGF1R P08069 1/20 0.48
PDGFRA P16234 8/20 0.46
FLT3 P36888 3/20 0.45
FLT4 P35916 2/20 0.45
CSF1R P07333 1/20 0.45
PDGFRB P09619 1/20 0.45
AURKB Q96GD4 2/20 0.44
AURKA O14965 1/20 0.44
RIPK2 O43353 1/20 0.44
ABCB11 O95342 1/20 0.44
ABL1 P00519 1/20 0.44
EGFR P00533 1/20 0.44
ERBB2 P04626 1/20 0.44
NTRK1 P04629 1/20 0.44
LCK P06239 1/20 0.44
PGR P06401 1/20 0.44

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
SCHEMBL20216622 0.86 MET (0.51) METAXLMERTKKDRIGF1R
SCHEMBL371684 0.83 MET (0.72) METAXLMERTKKDRIGF1R
SCHEMBL372754 0.79 MET (0.70) METAXLMERTKKDRIGF1R
SCHEMBL371760 0.79 KDR (0.67) METAXLMERTKKDRPDGFRA
SCHEMBL371630 0.77 MET (0.83) METAXLMERTKKDRIGF1R
SCHEMBL30314058 0.77 MET (0.83) METAXLMERTKKDRIGF1R
SCHEMBL4993698 0.75 MET (0.68) METAXLMERTKKDRIGF1R
SCHEMBL409601 0.75 MET (0.68) METAXLMERTKKDRIGF1R
SCHEMBL1893668 0.74 PDGFRA (0.77) METKDRIGF1RPDGFRAKIT
SCHEMBL1890654 0.74 PDGFRA (0.79) METAXLMERTKKDRPDGFRA

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-A2 C-MET MODULATORS AND METHODS OF USE Exelixis, Inc. (US) 2018-06-06 EP disclosed