SCHEMBL19370040

SCHEMBL19370040

COc1cc2nccc(Oc3ccc(NC(=O)C4(C(=O)Nc5ccc(C)cc5)CC4)cc3F)c2cc1OCCCN1CCOCC1

nearest known ligand 0.91

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MET P08581 17/20 0.91
FLT3 P36888 5/20 0.91
KDR P35968 5/20 0.91
AXL P30530 3/20 0.91
RET P07949 2/20 0.91
PDGFRB P09619 2/20 0.91
KIT P10721 2/20 0.91
PLK4 O00444 1/20 0.91
STK25 O00506 1/20 0.91
CIT O14578 1/20 0.91
AURKA O14965 1/20 0.91
CHUK O15111 1/20 0.91
MUSK O15146 1/20 0.91
EPHB6 O15197 1/20 0.91
MAPK13 O15264 1/20 0.91
MAP3K13 O43283 1/20 0.91
DAPK3 O43293 1/20 0.91
MAP3K7 O43318 1/20 0.91
RIPK2 O43353 1/20 0.91
JAK2 O60674 1/20 0.91

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
SCHEMBL15003127 1.00 MET (0.91) METFLT3KDRAXLRET
SCHEMBL372153 0.95 MET (1.00) METFLT3KDRAXLRET
Foretinib SCHEMBL371804 0.95 MET (1.00) METFLT3KDRAXLRET
Foretinib SCHEMBL30498609 0.95 MET (1.00) METFLT3KDRAXLRET
Foretinib SCHEMBL29358674 0.95 MET (1.00) METFLT3KDRAXLRET
SCHEMBL29693444 0.95 MET (1.00) METFLT3KDRAXLRET
Foretinib SCHEMBL2452880 0.94 MET (0.99) METFLT3KDRAXLRET
SCHEMBL16069963 0.94 MET (0.89) METFLT3KDRAXLRET
SCHEMBL16070096 0.93 MET (0.88) METFLT3KDRAXLRET
SCHEMBL16069974 0.93 MET (0.88) METFLT3KDRAXLRET

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-2409704-B1 c-Met modulators and methods of use EXELIXIS INC (US) 2017-09-20 EP disclosed