SCHEMBL5067239

SCHEMBL5067239

COc1cc(N/C(=C\[N+](=O)[O-])NCCCn2cnc(C)c2)cc(OC)c1OC

nearest known ligand 1.00 ✓ in ChEMBL — recovers established targets

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
QPCTL Q9NXS2 9/20 1.00
QPCT Q16769 11/20 0.67

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
SCHEMBL3628238 1.00 QPCTL (1.00) QPCTLQPCT
SCHEMBL14012458 1.00 QPCTL (1.00) QPCTLQPCT
SCHEMBL14012457 0.90 QPCTL (1.00) QPCTLQPCT
SCHEMBL3633424 0.90 QPCTL (1.00) QPCTLQPCT
SCHEMBL5064458 0.90 QPCTL (1.00) QPCTLQPCT
SCHEMBL10144452 0.84 QPCTL (0.73) QPCTLQPCT
SCHEMBL3661669 0.84 QPCTL (0.73) QPCTLQPCT
SCHEMBL3661673 0.84 QPCTL (0.73) QPCTLQPCT
SCHEMBL14012459 0.83 QPCTL (1.00) QPCTLQPCT
SCHEMBL5063790 0.83 QPCTL (1.00) QPCTLQPCT

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-8772508-B2 Inhibitors of glutaminyl cyclase PROBIODRUG AG (DE) 2014-07-08 US claimed
EP-2142513-B1 NITROVINYL-DIAMINE DERIVATIVES AS GLUTAMINYL CYCLASE INHIBITORS PROBIODRUG AG (DE) 2014-03-12 EP claimed
US-8772508-B2 Inhibitors of glutaminyl cyclase PROBIODRUG AG (DE) 2014-07-08 US disclosed
EP-2142513-B1 NITROVINYL-DIAMINE DERIVATIVES AS GLUTAMINYL CYCLASE INHIBITORS PROBIODRUG AG (DE) 2014-03-12 EP disclosed
US-20080292582-A1 imidazole derivatives; Alzheimer's Disease, Down syndrome and Huntington's Disease; hypotensive agents; sleeping and eating disorders, anxiolytic agents, antidepressants, antiepileptic agents; drug abuse/withdrawl; 1-(3,4-dimethoxyphenyl)-3-(3-(5-methyl-1H-imidazol-1-yl)propyl)thiourea PROBIODRUG AG (DE) 2008-11-27 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-20080292582-A1 imidazole derivatives; Alzheimer's Disease, Down syndrome and Huntington's Disease; hypotensive agents; sleeping and eating disorders, anxiolytic agents, antidepressants, antiepileptic agents; drug abuse/withdrawl; 1-(3,4-dimethoxyphenyl)-3-(3-(5-methyl-1H-imidazol-1-yl)propyl)thiourea HTT, MAPT, HYPK QPCTL 3689/4885QPCT 4555/4885

“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.