SCHEMBL12750545

SCHEMBL12750545

COc1cc2nccc(Oc3ccc(Nc4ncccc4C(=O)NCc4ccc(C)cn4)cc3)c2cc1OC

nearest known ligand 0.54

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
▸ KDR P35968 10/20 0.54
▸ PDGFRA P16234 6/20 0.54
▸ RET P07949 1/20 0.52
▸ AXL P30530 3/20 0.52
▸ KIT P10721 1/20 0.52
▸ FGFR2 P21802 4/20 0.52
▸ AURKA O14965 3/20 0.51
▸ LCK P06239 3/20 0.51
▸ TEK Q02763 3/20 0.51
▸ MET P08581 2/20 0.51
▸ AURKB Q96GD4 2/20 0.51
▸ MEN1 O00255 1/20 0.50
▸ MAPT P10636 1/20 0.50
▸ KMT2A Q03164 1/20 0.50
▸ LYN P07948 1/20 0.49
▸ FLT1 P17948 1/20 0.49

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
SCHEMBL1471959 0.90 AXL (0.60) KDRPDGFRARETAXLKIT
SCHEMBL1471825 0.90 RET (0.60) KDRPDGFRARETAXLKIT
SCHEMBL1472160 0.87 RET (0.58) KDRPDGFRARETAXLKIT
SCHEMBL1471406 0.86 MAPT (0.69) KDRPDGFRARETAXLKIT
SCHEMBL1472127 0.86 RET (0.59) KDRPDGFRARETAXLKIT
SCHEMBL1471744 0.86 PDGFRA (0.60) KDRPDGFRARETAXLKIT
SCHEMBL1472072 0.85 RET (0.61) KDRPDGFRARETAXLKIT
SCHEMBL1471628 0.85 RET (0.53) KDRPDGFRARETAXLKIT
SCHEMBL1472518 0.85 AXL (0.55) KDRPDGFRARETAXLKIT
SCHEMBL1472517 0.85 KDR (0.66) KDRPDGFRAAXLKITFGFR2

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
US-7915287-B2 Use treating hepatocyte growth factor (HGF)-mediated diseases such as cancer; inhibitors of c-Met; e.g. 3-(3-fluoro-4-(7-methoxyquinolin-4-yloxy)phenylamino)-N-phenylpyrazine-2-carboxamide AMGEN INC. (US) 2011-03-29 — — US disclosed
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