SCHEMBL3949246

SCHEMBL3949246

COc1ccccc1NC(=O)Nc1ccc2nc(Nc3ncnc4cc(OC)c(OC)cc34)sc2c1

nearest known ligand 0.60

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
KDR P35968 11/20 0.60
MEN1 O00255 2/20 0.57
NPC1 O15118 2/20 0.57
RAB9A P51151 2/20 0.57
KMT2A Q03164 2/20 0.57
EGFR P00533 7/20 0.55
KIT P10721 1/20 0.55
NTRK1 P04629 1/20 0.53
AURKB Q96GD4 3/20 0.52
AURKA O14965 3/20 0.52
MAPK14 Q16539 2/20 0.51
PDGFRA P16234 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
SCHEMBL3947263 0.92 KDR (0.72) KDRMEN1NPC1RAB9AKMT2A
SCHEMBL3945407 0.90 KDR (0.54) KDREGFRKITNTRK1
SCHEMBL3946532 0.90 KDR (0.74) KDRMEN1NPC1RAB9AKMT2A
SCHEMBL3946261 0.88 EGFR (0.70) KDREGFRAURKBAURKA
SCHEMBL3953259 0.88 KDR (0.63) KDREGFRKITNTRK1
SCHEMBL3947784 0.87 EGFR (0.61) KDREGFRKITAURKBAURKA
SCHEMBL3954129 0.87 KDR (0.72) KDRMEN1NPC1RAB9AKMT2A
SCHEMBL3947988 0.86 AURKB (0.71) KDREGFRAURKBAURKAMAPK14
SCHEMBL3954616 0.85 EGFR (0.62) KDREGFRKITMAPK14
SCHEMBL31067670 0.84 KDR (0.84) KDREGFRKITAURKBAURKA

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-7514460-B2 Benzazole analogues and uses thereof 4SC AG (DE) 2009-04-07 US disclosed
US-7514460-B2 Benzazole analogues and uses thereof 4SC AG (DE) 2009-04-07 US disclosed
US-7514460-B2 Benzazole analogues and uses thereof 4SC AG (DE) 2009-04-07 US disclosed
EP-1885719-A1 2,5- AND 2,6-DISUBSTITUTED BENZAZOLE DERIVATIVES USEFUL AS PROTEIN KINASE INHIBITORS 4SC AG (DE) 2008-02-13 EP disclosed
WO-2006066795-A1 2,5- AND 2,6-DISUBSTITUTED BENZAZOLE DERIVATIVES USEFUL AS PROTEIN KINASE INHIBITORS 4SC AG (DE) 2006-06-29 WO disclosed
US-20060135782-A1 Benzazole analogues and uses thereof 4SC AG (DE) 2006-06-22 US 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 (1 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-20060135782-A1 Benzazole analogues and uses thereof DCK, SBK3, DAPK3 KDR 1657/4885MEN1 2444/4885NPC1 4134/4885

“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.