SCHEMBL5826010

SCHEMBL5826010

COc1cc2nccc(Oc3ccc(N(Cc4ccc(Cl)cc4)C(=O)O)cc3)c2cc1OC

nearest known ligand 0.64

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
KDR P35968 12/20 0.64
PDGFRA P16234 12/20 0.64
AURKB Q96GD4 2/20 0.52
FLT3 P36888 1/20 0.52
PDGFRB P09619 2/20 0.52
FGFR2 P21802 2/20 0.52
KIT P10721 2/20 0.52
AXL P30530 1/20 0.52
CSF1R P07333 2/20 0.51
AURKA O14965 1/20 0.51
LCK P06239 1/20 0.51
MET P08581 1/20 0.51
BRAF P15056 1/20 0.51
FLT1 P17948 1/20 0.51
FLT4 P35916 1/20 0.51
TEK Q02763 1/20 0.51
RET P07949 1/20 0.51
DDR1 Q08345 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) KDRPDGFRAAURKBFLT3PDGFRB
SCHEMBL5825951 0.91 PDGFRA (0.63) KDRPDGFRAAURKBFLT3PDGFRB
SCHEMBL5826016 0.91 PDGFRA (0.59) KDRPDGFRAAURKBFLT3PDGFRB
SCHEMBL371517 0.91 PDGFRA (0.62) KDRPDGFRAPDGFRBFGFR2KIT
SCHEMBL5825831 0.91 KDR (0.60) KDRPDGFRAFGFR2KITAXL
SCHEMBL5825647 0.90 KDR (0.64) KDRPDGFRAAURKBFLT3FGFR2
SCHEMBL5826044 0.90 PDGFRA (0.56) KDRPDGFRAAURKBFLT3PDGFRB
SCHEMBL5825982 0.88 FGFR2 (0.68) KDRPDGFRAAURKBFLT3PDGFRB
SCHEMBL5826045 0.87 FGFR2 (0.56) KDRPDGFRAAURKBFLT3PDGFRB
SCHEMBL5825683 0.87 KDR (0.61) KDRPDGFRAAURKBPDGFRBFGFR2

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