SCHEMBL6773667

SCHEMBL6773667

CCN(CC)C(=O)c1ccc(C(c2cccc3cccnc23)N2CCN(Cc3ccco3)CC2)cc1

nearest known ligand 0.69

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
OPRD1 P41143 18/20 0.69
OPRM1 P35372 8/20 0.69
OPRK1 P41145 4/20 0.69
KCNH2 Q12809 4/20 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
SCHEMBL4681851 0.86 OPRD1 (0.73) OPRD1OPRM1OPRK1KCNH2
SCHEMBL4685133 0.86 OPRD1 (0.68) OPRD1OPRM1OPRK1KCNH2
SCHEMBL7083219 0.86 OPRD1 (0.72) OPRD1OPRM1OPRK1KCNH2
Hydrochloric Acid SCHEMBL6772092 0.86 OPRD1 (0.72) OPRD1OPRM1OPRK1KCNH2
SCHEMBL7086156 0.85 OPRD1 (0.69) OPRD1OPRM1OPRK1KCNH2
Hydrochloric Acid SCHEMBL6778511 0.85 OPRD1 (0.71) OPRD1OPRM1OPRK1KCNH2
SCHEMBL6769093 0.85 OPRD1 (0.71) OPRD1OPRM1OPRK1KCNH2
Hydrochloric Acid SCHEMBL6773724 0.85 OPRD1 (0.68) OPRD1OPRM1OPRK1KCNH2
SCHEMBL4680591 0.83 OPRD1 (0.68) OPRD1OPRM1OPRK1KCNH2
SCHEMBL7083492 0.83 OPRD1 (0.68) OPRD1OPRM1OPRK1KCNH2

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 10 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-1225465-C Novel compounds ASTRAZENECA AB (SE) 2005-11-02 CN claimed
US-6784181-B2 LIGANDS FOR THE DELTA RECEPTOR ASTRAZENECA AB (SE) 2004-08-31 US claimed
EP-1242402-B1 NOVEL COMPOUNDS ASTRAZENECA AB (SE) 2003-11-12 EP claimed
CN-1434816-A Novel compounds ASTRAZENECA AB (SE) 2003-08-06 CN claimed
US-20030119845-A1 Novel compounds ASTRAZENECA AB (SE) 2003-06-26 US claimed
EP-1242402-A2 NOVEL COMPOUNDS AstraZeneca AB (SE) 2002-09-25 EP claimed
WO-2001045637-A2 NOVEL 4(PIPERAZINYL (8-QUINOLINYL)METYL)BENZAMIDES ASTRAZENECA AB (SE) 2001-06-28 WO claimed
US-6784181-B2 LIGANDS FOR THE DELTA RECEPTOR ASTRAZENECA AB (SE) 2004-08-31 US disclosed
EP-1242402-B1 NOVEL COMPOUNDS ASTRAZENECA AB (SE) 2003-11-12 EP disclosed
US-20030119845-A1 Novel compounds ASTRAZENECA AB (SE) 2003-06-26 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-20030119845-A1 Novel compounds OPRK1, OPRM1, OPRL1 OPRD1 4/4885OPRM1 2/4885OPRK1 1/4885

“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.