SCHEMBL6839338

SCHEMBL6839338

O=C1NCN(c2ccccc2)C12CCN(C1CCCCCCCCC1)CC2

nearest known ligand 1.00 ✓ in ChEMBL — recovers established targets

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
SLC18A3 Q16572 1/20 0.74
OPRM1 P35372 6/20 0.73
OPRL1 P41146 6/20 0.73
OPRD1 P41143 2/20 0.73
OPRK1 P41145 2/20 0.73
SLC6A9 P48067 5/20 0.73
SLC6A5 Q9Y345 4/20 0.71

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
SCHEMBL6839077 1.00 SLC18A3 (0.74) SLC18A3OPRM1OPRL1OPRD1OPRK1
Hydrochloric Acid SCHEMBL7709374 0.99 SLC18A3 (0.72) SLC18A3OPRM1OPRL1OPRD1OPRK1
Hydrochloric Acid SCHEMBL7703755 0.99 SLC18A3 (0.72) SLC18A3OPRM1OPRL1OPRD1OPRK1
Hydrochloric Acid SCHEMBL7706463 0.99 SLC18A3 (0.72) SLC18A3OPRM1OPRL1OPRD1OPRK1
Hydrochloric Acid SCHEMBL7706445 0.99 SLC18A3 (0.72) SLC18A3OPRM1OPRL1OPRD1OPRK1
Hydrochloric Acid SCHEMBL7709447 0.99 SLC18A3 (0.72) SLC18A3OPRM1OPRL1OPRD1OPRK1
Hydrochloric Acid SCHEMBL7706374 0.99 SLC18A3 (0.72) SLC18A3OPRM1OPRL1OPRD1OPRK1
Hydrochloric Acid SCHEMBL7703785 0.99 SLC18A3 (0.72) SLC18A3OPRM1OPRL1OPRD1OPRK1
Hydrochloric Acid SCHEMBL7707065 0.92 SLC18A3 (0.67) SLC18A3OPRM1OPRL1OPRD1OPRK1
Hydrochloric Acid SCHEMBL7707063 0.92 SLC18A3 (0.67) SLC18A3OPRM1OPRL1OPRD1OPRK1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0921125-B1 1,3,8-Triazaspiro[4,5]decan-4-on derivatives HOFFMANN LA ROCHE (CH) 2002-01-30 EP claimed
EP-0921125-A1 1,3,8-Triaza-spiro 4,5 decan-4-on derivatives F. HOFFMANN-LA ROCHE AG (CH) 1999-06-09 EP claimed
US-20040067950-A1 High affinity ligands for nociceptin receptor ORL-1 SCHERING-PLOUGH CORPORATION 2004-04-08 US disclosed
EP-1200087-A1 NOCICEPTIN RECEPTOR ORL-1 AGONISTS FOR USE IN TREATING COUGH SCHERING CORPORATION (US) 2002-05-02 EP disclosed
EP-0921125-B1 1,3,8-Triazaspiro[4,5]decan-4-on derivatives HOFFMANN LA ROCHE (CH) 2002-01-30 EP disclosed
WO-2001007050-A1 NOCICEPTIN RECEPTOR ORL-1 AGONISTS FOR USE IN TREATING COUGH SCHERING CORPORATION (US) 2001-02-01 WO disclosed
US-6043366-A USEFUL IN TREATING DISORDERS INVOLVING THE ORPHANIN FQ(A SEVENTEEN AMINO ACID LONG PEPTIDE) RECEPTOR. HOFFMAN-LA ROCHE INC. (US) 2000-03-28 US disclosed
EP-0921125-A1 1,3,8-Triaza-spiro 4,5 decan-4-on derivatives F. HOFFMANN-LA ROCHE AG (CH) 1999-06-09 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 (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-20040067950-A1 High affinity ligands for nociceptin receptor ORL-1 OPRL1, OPRD1, OGFRL1 SLC18A3 1514/4885OPRM1 5/4885OPRL1 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.