SCHEMBL5825458

SCHEMBL5825458

CCN(CC)CCCOC(=O)Nc1cc(C)c(Oc2ccnc3cc(OC)c(OC)cc23)cc1C

nearest known ligand 0.51

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
KDR P35968 17/20 0.51
EGFR P00533 6/20 0.49
SRC P12931 2/20 0.48
TGFBR1 P36897 2/20 0.48
KIT P10721 1/20 0.46
PDGFRA P16234 1/20 0.46

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
SCHEMBL5825503 0.90 KDR (0.60) KDREGFRSRCTGFBR1KIT
SCHEMBL5824642 0.89 KDR (0.56) KDREGFRSRCTGFBR1KIT
SCHEMBL5825902 0.89 KDR (0.56) KDREGFRSRCTGFBR1KIT
SCHEMBL5825397 0.88 KDR (0.58) KDREGFRSRCTGFBR1KIT
SCHEMBL5825455 0.88 KDR (0.50) KDREGFRSRCTGFBR1KIT
SCHEMBL5825408 0.88 SRC (0.48) KDREGFRSRCTGFBR1KIT
SCHEMBL5824875 0.88 SRC (0.52) KDREGFRSRCTGFBR1KIT
SCHEMBL5825266 0.86 KDR (0.53) KDREGFRSRCTGFBR1KIT
SCHEMBL5825720 0.86 SRC (0.50) KDREGFRSRCTGFBR1KIT
SCHEMBL5824438 0.85 SRC (0.49) KDREGFRSRCTGFBR1KIT

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 KDR 4/4885EGFR 24/4885SRC 272/4885
US-20040132727-A1 Quinoline and quinazoline derivatives and drugs containing the same PDGFRA, PDGFRB, PDGFA KDR 5/4885EGFR 20/4885SRC 195/4885

“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.