SCHEMBL8556030

SCHEMBL8556030

COc1cc2nccc(Oc3ccc(N(C(N)=O)c4ccc([N+](=O)[O-])cc4)cc3)c2cc1OC

nearest known ligand 0.69

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
PDGFRA P16234 10/20 0.69
KDR P35968 9/20 0.69
MET P08581 2/20 0.54
PDGFRB P09619 1/20 0.54
FGFR2 P21802 3/20 0.51
AURKA O14965 1/20 0.51
ABL1 P00519 1/20 0.51
LCK P06239 1/20 0.51
LYN P07948 1/20 0.51
TEK Q02763 1/20 0.51
AURKB Q96GD4 1/20 0.51
KIT P10721 1/20 0.48
AXL P30530 1/20 0.48

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
SCHEMBL8554250 0.92 PDGFRA (0.64) PDGFRAKDRMETPDGFRBAURKA
SCHEMBL8552489 0.89 PDGFRA (0.65) PDGFRAKDRMETPDGFRBFGFR2
SCHEMBL558651 0.87 PDGFRA (0.80) PDGFRAKDRMETPDGFRBFGFR2
SCHEMBL8552405 0.87 KDR (0.54) PDGFRAKDRMETPDGFRBFGFR2
SCHEMBL8551461 0.87 PDGFRA (0.59) PDGFRAKDRMETPDGFRBFGFR2
SCHEMBL8552653 0.86 PDGFRA (0.61) PDGFRAKDRMETPDGFRBFGFR2
SCHEMBL8552659 0.86 PDGFRA (0.67) PDGFRAKDRMETPDGFRBFGFR2
SCHEMBL8553956 0.85 FGFR2 (0.59) PDGFRAKDRMETPDGFRBFGFR2
SCHEMBL7481946 0.85 PDGFRA (0.76) PDGFRAKDRMETPDGFRBFGFR2
SCHEMBL8554139 0.84 KDR (0.63) PDGFRAKDRMETPDGFRBFGFR2

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 disclosed