SCHEMBL5825883

SCHEMBL5825883

COc1cc2nccc(Oc3ccc(NC(=S)NCCN4CCCCC4)c(C)c3C)c2cc1OC

nearest known ligand 0.52

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
ACHE P22303 1/20 0.52
MET P08581 13/20 0.49
FGFR2 P21802 2/20 0.49
KIT P10721 1/20 0.47
PDGFRA P16234 1/20 0.47
EHMT2 Q96KQ7 3/20 0.46
EHMT1 Q9H9B1 3/20 0.46
AXL P30530 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
SCHEMBL5825797 0.95 MET (0.51) METFGFR2EHMT2EHMT1
SCHEMBL5824717 0.90 GAA (0.54) METPDGFRAEHMT2EHMT1AXL
SCHEMBL5825370 0.89 GAA (0.52) METFGFR2PDGFRAEHMT2EHMT1
SCHEMBL5824985 0.88 QPCT (0.49) METFGFR2KITAXL
SCHEMBL5825974 0.88 ACHE (0.52) ACHEMETFGFR2KITPDGFRA
SCHEMBL5824630 0.87 ACHE (0.50) ACHEMETFGFR2PDGFRAEHMT2
SCHEMBL5825310 0.87 AXL (0.54) METFGFR2KITPDGFRAAXL
SCHEMBL5825334 0.85 FGFR2 (0.52) METFGFR2KITPDGFRAAXL
SCHEMBL5824755 0.84 AXL (0.49) METFGFR2KITPDGFRAAXL
SCHEMBL5825116 0.84 KDR (0.53) METKITPDGFRAEHMT2EHMT1

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 5 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 claimed
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 ACHE 3138/4885MET 84/4885FGFR2 90/4885
US-20040132727-A1 Quinoline and quinazoline derivatives and drugs containing the same PDGFRA, PDGFRB, PDGFA ACHE 3471/4885MET 40/4885FGFR2 78/4885

“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.