Predicted protein targets (top 4)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | OPRL1 | P41146 | 18/20 | 0.56 |
| ▸ | OPRM1 | P35372 | 16/20 | 0.56 |
| ▸ | AGTR2 | P50052 | 1/20 | 0.47 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.43 |
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.
| Compound | similarity | top predicted | shared targets | |
|---|---|---|---|---|
| Hydrochloric Acid SCHEMBL5166358 | 0.99 | OPRL1 (0.57) | OPRL1OPRM1AGTR2 | |
| SCHEMBL5165283 | 0.85 | OPRM1 (0.47) | OPRL1OPRM1 | |
| Hydrochloric Acid SCHEMBL5165828 | 0.84 | OPRM1 (0.47) | OPRL1OPRM1 | |
| Hydrochloric Acid SCHEMBL5159869 | 0.84 | OPRM1 (0.42) | OPRL1OPRM1AGTR2L3MBTL1 | |
| Hydrochloric Acid SCHEMBL302608 | 0.77 | OPRL1 (0.58) | OPRL1OPRM1 | |
| SCHEMBL4861071 | 0.75 | OPRM1 (0.67) | OPRL1OPRM1 | |
| SCHEMBL2310690 | 0.74 | AGTR2 (0.53) | AGTR2L3MBTL1 | |
| SCHEMBL6486622 | 0.74 | AGTR2 (0.47) | OPRM1AGTR2L3MBTL1 | |
| SCHEMBL6486620 | 0.74 | AGTR2 (0.47) | OPRM1AGTR2L3MBTL1 | |
| Hydrochloric Acid SCHEMBL1327577 | 0.74 | AGTR2 (0.52) | OPRM1AGTR2L3MBTL1 |
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.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-1392641-B1 | SUBSTITUTED CYCLOHEXANE-1,4-DIAMINE DERIVATIVES | GRUENENTHAL GMBH (DE) | 2007-04-11 | — | — | EP | claimed |
| EP-1392641-A1 | SUBSTITUTED CYCLOHEXANE-1,4-DIAMINE DERIVATIVES | Grünenthal GmbH (DE) | 2004-03-03 | — | — | EP | claimed |
| WO-2002090317-A1 | SUBSTITUTED CYCLOHEXANE-1,4-DIAMINE DERIVATIVES | Grünenthal GmbH (DE) | 2002-11-14 | — | — | WO | claimed |
| EP-1392641-B1 | SUBSTITUTED CYCLOHEXANE-1,4-DIAMINE DERIVATIVES | GRUENENTHAL GMBH (DE) | 2007-04-11 | — | — | EP | disclosed |
| EP-1392641-A1 | SUBSTITUTED CYCLOHEXANE-1,4-DIAMINE DERIVATIVES | Grünenthal GmbH (DE) | 2004-03-03 | — | — | EP | disclosed |
| EP-1385493-A1 | SUBSTITUTED CYCLOHEXAN-1,4-DIAMINE DERIVATIVES WITH CONSTIPATING AND PERIPHERAL ANALGESIC PROPERTIES | Grünenthal GmbH (DE) | 2004-02-04 | — | — | EP | disclosed |
| WO-2002089783-A1 | SUBSTITUTED CYCLOHEXAN-1,4-DIAMINE DERIVATIVES WITH CONSTIPATING AND PERIPHERAL ANALGESIC PROPERTIES | Grünenthal GmbH (DE) | 2002-11-14 | — | — | WO | disclosed |
| WO-2002090317-A1 | SUBSTITUTED CYCLOHEXANE-1,4-DIAMINE DERIVATIVES | Grünenthal GmbH (DE) | 2002-11-14 | — | — | WO | disclosed |