SCHEMBL8554780

SCHEMBL8554780

COc1ccc(N(C(N)=O)c2ccc(Oc3ncnc4cc(OC)c(OC)cc34)cc2)cc1

nearest known ligand 0.66

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
KDR P35968 12/20 0.66
PDGFRA P16234 1/20 0.66
CSF1R P07333 6/20 0.58
AURKB Q96GD4 2/20 0.58
AURKA O14965 1/20 0.58
MET P08581 1/20 0.58
TEK Q02763 1/20 0.58
PDGFRB P09619 5/20 0.55
FLT4 P35916 5/20 0.55
FLT3 P36888 4/20 0.55
RAF1 P04049 1/20 0.54
BRAF P15056 1/20 0.54
RET P07949 1/20 0.54
KIF5B P33176 1/20 0.54

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
SCHEMBL8556537 0.92 KDR (0.61) KDRPDGFRACSF1RAURKBAURKA
SCHEMBL8554076 0.89 KDR (0.58) KDRPDGFRACSF1RAURKBAURKA
SCHEMBL8552819 0.87 KDR (0.56) KDRPDGFRACSF1RAURKBAURKA
SCHEMBL8552489 0.83 PDGFRA (0.65) KDRPDGFRAAURKBAURKAMET
SCHEMBL14967551 0.82 KDR (0.67) KDRPDGFRACSF1RAURKBAURKA
SCHEMBL7484941 0.81 KDR (0.59) KDRPDGFRACSF1RAURKBAURKA
SCHEMBL30448125 0.81 KDR (0.65) KDRPDGFRACSF1RAURKBAURKA
SCHEMBL28979421 0.81 KDR (0.65) KDRPDGFRACSF1RAURKBAURKA
SCHEMBL24262968 0.81 KDR (0.58) KDRPDGFRACSF1RAURKBAURKA
SCHEMBL5824758 0.80 KDR (0.53) KDRPDGFRACSF1RAURKBAURKA

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-0860433-A1 QUINOLINE DERIVATIVES AND QUINAZOLINE DERIVATIVES INHIBITING AUTOPHOSPHORYLATION OF GROWTH FACTOR RECEPTOR ORIGINATING IN PLATELET AND PHARMACEUTICAL COMPOSITIONS CONTAINING THE SAME KIRIN BEER KABUSHIKI KAISHA (JP) 1998-08-26 EP claimed