SCHEMBL5826044

SCHEMBL5826044

COc1cc2nccc(Oc3ccc(N(Cc4ccncc4)C(=O)O)cc3)c2cc1OC

nearest known ligand 0.58

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
PDGFRA P16234 8/20 0.56
KDR P35968 5/20 0.56
PDGFRB P09619 1/20 0.54
FGFR2 P21802 4/20 0.53
KIT P10721 2/20 0.53
FLT3 P36888 1/20 0.52
AURKB Q96GD4 1/20 0.52
MET P08581 4/20 0.52
AXL P30530 1/20 0.51

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
SCHEMBL5825958 0.93 PDGFRA (0.62) PDGFRAKDRPDGFRBFGFR2KIT
SCHEMBL371517 0.93 PDGFRA (0.62) PDGFRAKDRPDGFRBFGFR2KIT
SCHEMBL5825951 0.91 PDGFRA (0.63) PDGFRAKDRPDGFRBFGFR2KIT
SCHEMBL5826016 0.91 PDGFRA (0.59) PDGFRAKDRPDGFRBFGFR2KIT
SCHEMBL5825647 0.90 KDR (0.64) PDGFRAKDRFGFR2KITFLT3
SCHEMBL5826010 0.90 KDR (0.64) PDGFRAKDRPDGFRBFGFR2KIT
SCHEMBL5826045 0.89 FGFR2 (0.56) PDGFRAKDRPDGFRBFGFR2KIT
SCHEMBL5825982 0.88 FGFR2 (0.68) PDGFRAKDRPDGFRBFGFR2KIT
SCHEMBL5825336 0.88 PDGFRA (0.59) PDGFRAKDRFGFR2KITMET
SCHEMBL5825584 0.87 PDGFRA (0.59) PDGFRAKDRFGFR2KITAURKB

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-7135466-B2 Quinoline and quinazoline derivatives and drugs containing the same KIRIN BEER KABUSHIKI KAISHA (JP) 2006-11-14 US claimed