Predicted protein targets (top 8)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP19A1 | P11511 | 8/20 | 0.38 |
| ▸ | S1PR2 | O95136 | 1/20 | 0.31 |
| ▸ | S1PR4 | O95977 | 1/20 | 0.31 |
| ▸ | S1PR1 | P21453 | 1/20 | 0.31 |
| ▸ | S1PR3 | Q99500 | 1/20 | 0.31 |
| ▸ | S1PR5 | Q9H228 | 1/20 | 0.31 |
| ▸ | CNR2 | P34972 | 7/20 | 0.31 |
| ▸ | EPHX1 | P07099 | 1/20 | 0.31 |
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 | |
|---|---|---|---|---|
| SCHEMBL10394276 | 0.92 | CYP19A1 (0.39) | CYP19A1CNR2EPHX1 | |
| SCHEMBL16825226 | 0.77 | — | — | |
| SCHEMBL16599750 | 0.73 | — | — | |
| SCHEMBL31239719 | 0.72 | — | — | |
| SCHEMBL23568278 | 0.70 | CYP19A1 (0.38) | CYP19A1EPHX1 | |
| SCHEMBL7640444 | 0.70 | CYP1A2 (0.31) | — | |
| SCHEMBL27446512 | 0.70 | ALDH1A1 (0.31) | — | |
| SCHEMBL28605156 | 0.69 | NOS1 (0.38) | CYP19A1 | |
| SCHEMBL3267370 | 0.69 | CYP1A2 (0.43) | CYP19A1S1PR2S1PR4S1PR1S1PR3 | |
| SCHEMBL31239801 | 0.68 | — | — |
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-0985651-B1 | Process for obtaining mixtures of isomeric acyloctahydronaphthalenes | MILLENNIUM SPECIALTY CHEM INC (US) | 2003-10-22 | — | — | EP | disclosed |
| EP-0985651-B1 | Process for obtaining mixtures of isomeric acyloctahydronaphthalenes | MILLENNIUM SPECIALTY CHEM INC (US) | 2003-10-22 | — | — | EP | disclosed |
| US-6160182-A | Process for obtaining mixtures of isomeric acyloctahydronaphthalenes | MILLENNIUM SPECIALTY CHEMICALS (US) | 2000-12-12 | — | — | US | disclosed |
| US-6160182-A | Process for obtaining mixtures of isomeric acyloctahydronaphthalenes | MILLENNIUM SPECIALTY CHEMICALS (US) | 2000-12-12 | — | — | US | disclosed |
| US-6160182-A | Process for obtaining mixtures of isomeric acyloctahydronaphthalenes | MILLENNIUM SPECIALTY CHEMICALS (US) | 2000-12-12 | — | — | US | disclosed |
| EP-0985651-A1 | Process for obtaining mixtures of isomeric acyloctahydronaphthalenes | Millennium Specialty Chemicals, Inc. (US) | 2000-03-15 | — | — | EP | disclosed |
| EP-0985651-A1 | Process for obtaining mixtures of isomeric acyloctahydronaphthalenes | Millennium Specialty Chemicals, Inc. (US) | 2000-03-15 | — | — | EP | disclosed |
| EP-0985651-A1 | Process for obtaining mixtures of isomeric acyloctahydronaphthalenes | Millennium Specialty Chemicals, Inc. (US) | 2000-03-15 | — | — | EP | disclosed |