SCHEMBL5636037

SCHEMBL5636037

COc1cc2nccc(Oc3cc(C)c(NC(=O)Nc4cccc(F)c4OC)cc3C)c2cc1OC

nearest known ligand 0.61

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
KDR P35968 17/20 0.61
PDGFRA P16234 16/20 0.61
KIT P10721 1/20 0.55
FGFR2 P21802 1/20 0.55
AXL P30530 1/20 0.55
SRC P12931 1/20 0.51
TGFBR1 P36897 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
SCHEMBL5204832 0.88 KDR (0.62) KDRPDGFRAKITFGFR2AXL
SCHEMBL5201453 0.87 PDGFRA (0.70) KDRPDGFRAKITFGFR2AXL
SCHEMBL5240346 0.87 PDGFRA (0.74) KDRPDGFRAKITFGFR2AXL
SCHEMBL5204991 0.85 KDR (0.80) KDRPDGFRAKITFGFR2AXL
SCHEMBL5207860 0.85 PDGFRA (0.73) KDRPDGFRAKITFGFR2AXL
SCHEMBL5824866 0.83 PDGFRA (0.55) KDRPDGFRAKITSRCTGFBR1
SCHEMBL5825478 0.83 SRC (0.54) KDRPDGFRAKITFGFR2AXL
SCHEMBL5201709 0.81 PDGFRA (0.64) KDRPDGFRAKITFGFR2AXL
SCHEMBL5208717 0.81 PDGFRA (0.76) KDRPDGFRA
SCHEMBL5824978 0.80 SRC (0.60) KDRPDGFRAKITFGFR2AXL

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 6 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20070027318-A1 Quinoline derivatives and quinazoline derivatives KIRIN BEER KABUSHIKI KAISHA (JP) 2007-02-01 US disclosed
US-7169789-B2 Quinoline derivatives and quinazoline derivatives KIRIN BEER KABUSHIKI KAISHA (JP) 2007-01-30 US disclosed
US-20040209905-A1 Quinoline derivatives and quinazoline derivatives KIRIN BEER KABUSHIKI KAISHA (JP) 2004-10-21 US disclosed
EP-1384712-A1 Derivatives of N-((quinolinyl)oxy)-phenyl)-urea and N-((quinazolinyl)oxy)-phenyl)-urea with antitumor activity KIRIN BEER KABUSHIKI KAISHA (JP) 2004-01-28 EP disclosed
EP-1153920-B1 QUINOLINE DERIVATIVES AND QUINAZOLINE DERIVATIVES KIRIN BREWERY (JP) 2003-10-29 EP disclosed
EP-1153920-A1 QUINOLINE DERIVATIVES AND QUINAZOLINE DERIVATIVES KIRIN BEER KABUSHIKI KAISHA (JP) 2001-11-14 EP disclosed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (2 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.

PatentTitleText reads most aboutPredicted target · text-rank
US-20070027318-A1 Quinoline derivatives and quinazoline derivatives CYTH3, NQO2, NRAS KDR 2466/4885PDGFRA 3108/4885KIT 629/4885
US-20040209905-A1 Quinoline derivatives and quinazoline derivatives RABL3, NRAS, CYTH3 KDR 3106/4885PDGFRA 3103/4885KIT 866/4885

“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.