SCHEMBL3946261

SCHEMBL3946261

COc1ccccc1NC(=O)Nc1ccc2nc(Nc3ncnc4cc(OCCCN5CCN(C)CC5)c(OC)cc34)sc2c1

nearest known ligand 0.70

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
EGFR P00533 20/20 0.70
KDR P35968 17/20 0.70
AURKA O14965 9/20 0.61
TEK Q02763 9/20 0.61
PDGFRB P09619 8/20 0.61
AURKB Q96GD4 8/20 0.61
ERBB2 P04626 8/20 0.61
FLT4 P35916 6/20 0.61

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
SCHEMBL3947704 0.95 EGFR (0.79) EGFRKDRAURKATEKPDGFRB
SCHEMBL2189126 0.95 EGFR (0.70) EGFRKDRAURKATEKPDGFRB
SCHEMBL3953281 0.94 EGFR (0.64) EGFRKDRAURKATEKPDGFRB
SCHEMBL3947637 0.94 EGFR (0.72) EGFRKDRAURKATEKPDGFRB
SCHEMBL3946804 0.94 EGFR (0.78) EGFRKDRAURKATEKPDGFRB
Acetic Acid SCHEMBL1504854 0.93 EGFR (0.68) EGFRKDRAURKATEKPDGFRB
SCHEMBL3945590 0.92 KDR (0.66) EGFRKDRAURKATEKPDGFRB
SCHEMBL3948294 0.92 EGFR (0.65) EGFRKDRAURKATEKPDGFRB
SCHEMBL3947867 0.92 EGFR (0.66) EGFRKDRAURKATEKPDGFRB
SCHEMBL3947281 0.92 EGFR (0.69) EGFRKDRAURKATEKPDGFRB

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 EGFR 437/4885KDR 1657/4885AURKA 139/4885

“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.