SCHEMBL5825818

SCHEMBL5825818

COc1cc2ncnc(Oc3ccc(NC(=O)OCc4ccc(C(C)(C)C)cc4)cc3)c2cc1OC

nearest known ligand 0.72

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
KDR P35968 14/20 0.72
BRAF P15056 4/20 0.65
RAF1 P04049 2/20 0.65
PDGFRA P16234 2/20 0.62
CSF1R P07333 3/20 0.60
PDGFRB P09619 3/20 0.58
FLT4 P35916 3/20 0.58
FLT3 P36888 2/20 0.58
MAPK14 Q16539 1/20 0.57
TNNI3K Q59H18 1/20 0.57
MET P08581 1/20 0.55
KIT P10721 1/20 0.55
SRC P12931 1/20 0.55
FLT1 P17948 1/20 0.55

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
SCHEMBL5825215 0.92 KDR (0.77) KDRBRAFRAF1PDGFRACSF1R
SCHEMBL5824876 0.90 KDR (0.79) KDRRAF1PDGFRACSF1RPDGFRB
SCHEMBL5824482 0.89 KDR (0.74) KDRPDGFRACSF1RPDGFRBFLT4
SCHEMBL5824577 0.89 KDR (0.77) KDRBRAFRAF1PDGFRACSF1R
SCHEMBL5824398 0.89 KDR (0.77) KDRRAF1PDGFRACSF1RPDGFRB
SCHEMBL5824917 0.88 KDR (0.75) KDRRAF1PDGFRACSF1RPDGFRB
SCHEMBL5825169 0.87 KDR (0.62) KDRBRAFRAF1PDGFRAFLT4
SCHEMBL5825356 0.86 FGFR2 (0.67) KDRPDGFRAPDGFRBFLT3MET
SCHEMBL5824360 0.85 KDR (0.65) KDRBRAFRAF1PDGFRACSF1R
SCHEMBL5825258 0.83 KDR (0.75) KDRBRAFRAF1PDGFRACSF1R

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 4/4885BRAF 385/4885RAF1 115/4885
US-20040132727-A1 Quinoline and quinazoline derivatives and drugs containing the same PDGFRA, PDGFRB, PDGFA KDR 5/4885BRAF 296/4885RAF1 44/4885

“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.