SCHEMBL6834648

SCHEMBL6834648

O=C1NCN(c2ccccc2)C12CCN(C1C[C@H]3CCCCCC[C@@H]13)CC2

nearest known ligand 0.71

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
SLC18A3 Q16572 1/20 0.71
SLC6A9 P48067 10/20 0.70
SLC6A5 Q9Y345 7/20 0.68
OPRM1 P35372 4/20 0.68
OPRL1 P41146 4/20 0.68

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
SCHEMBL6834651 1.00 SLC18A3 (0.71) SLC18A3SLC6A9SLC6A5OPRM1OPRL1
Hydrochloric Acid SCHEMBL7706385 0.99 SLC18A3 (0.69) SLC18A3SLC6A9SLC6A5OPRM1OPRL1
Hydrochloric Acid SCHEMBL7706383 0.99 SLC18A3 (0.69) SLC18A3SLC6A9SLC6A5OPRM1OPRL1
Hydrochloric Acid SCHEMBL7706308 0.90 SLC18A3 (0.69) SLC18A3SLC6A9SLC6A5OPRM1OPRL1
Hydrochloric Acid SCHEMBL7706310 0.90 SLC18A3 (0.69) SLC18A3SLC6A9SLC6A5OPRM1OPRL1
Hydrochloric Acid SCHEMBL8049905 0.90 SLC18A3 (0.72) SLC18A3SLC6A9SLC6A5OPRM1OPRL1
Hydrochloric Acid SCHEMBL7709383 0.89 SLC18A3 (0.71) SLC18A3SLC6A9SLC6A5OPRM1OPRL1
Hydrochloric Acid SCHEMBL7709380 0.89 SLC18A3 (0.71) SLC18A3SLC6A9SLC6A5OPRM1OPRL1
Hydrochloric Acid SCHEMBL7701388 0.89 SLC6A9 (0.64) SLC18A3SLC6A9SLC6A5OPRM1OPRL1
Hydrochloric Acid SCHEMBL7701391 0.85 SLC6A9 (0.65) SLC18A3SLC6A9SLC6A5OPRM1OPRL1

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
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-0921125-B1 1,3,8-Triazaspiro[4,5]decan-4-on derivatives HOFFMANN LA ROCHE (CH) 2002-01-30 EP 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 1514/4885SLC6A9 2312/4885SLC6A5 2065/4885

“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.