SCHEMBL5824898

SCHEMBL5824898

COc1cc2nccc(Oc3ccc(NC(=O)OCC4CCCCCC4)cc3)c2cc1OC

nearest known ligand 0.83

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
PDGFRA P16234 17/20 0.83
KIT P10721 5/20 0.83
KDR P35968 10/20 0.63
FLT3 P36888 1/20 0.58
AURKB Q96GD4 1/20 0.58
MET P08581 1/20 0.58
HDAC1 Q13547 1/20 0.58
AXL P30530 1/20 0.58

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
SCHEMBL5824748 1.00 PDGFRA (0.83) PDGFRAKITKDRFLT3AURKB
SCHEMBL5824663 0.99 PDGFRA (0.82) PDGFRAKITKDRFLT3AURKB
SCHEMBL5824592 0.97 PDGFRA (0.79) PDGFRAKITKDRFLT3AURKB
SCHEMBL5824520 0.96 PDGFRA (0.77) PDGFRAKITKDRFLT3AURKB
SCHEMBL5825564 0.91 PDGFRA (1.00) PDGFRAKITKDRFLT3AURKB
SCHEMBL5825054 0.86 KDR (0.73) PDGFRAKITKDRFLT3MET
SCHEMBL5824888 0.86 KDR (0.73) PDGFRAKITKDRFLT3MET
SCHEMBL5825900 0.86 PDGFRA (0.73) PDGFRAKITKDRFLT3AURKB
SCHEMBL5824690 0.86 PDGFRA (0.73) PDGFRAKITKDRFLT3AURKB
SCHEMBL5090504 0.85 PDGFRA (0.83) PDGFRAKITKDRMETHDAC1

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 4 patents. 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 disclosed
US-20060211717-A1 Quinoline and quinazoline derivatives and drugs containing the same KIRIN BEER KABUSHIKI KAISHA (JP) 2006-09-21 US disclosed
US-20040132727-A1 Quinoline and quinazoline derivatives and drugs containing the same KIRIN HOLDINGS KABUSHIKI KAISHA (JP) 2004-07-08 US disclosed
EP-1243582-A1 QUINOLINE AND QUINAZOLINE DERIVATIVES AND DRUGS CONTAINING THE SAME KIRIN BEER KABUSHIKI KAISHA (JP) 2002-09-25 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-20060211717-A1 Quinoline and quinazoline derivatives and drugs containing the same PDGFRA, PDGFRB, PDGFA PDGFRA 1/4885KIT 401/4885KDR 4/4885
US-20040132727-A1 Quinoline and quinazoline derivatives and drugs containing the same PDGFRA, PDGFRB, PDGFA PDGFRA 1/4885KIT 499/4885KDR 5/4885

“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.