⚠ Novel chemotype — no close known analogue (best Tanimoto < 0.3). Unexplored chemical space relative to ChEMBL.
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 | |
|---|---|---|---|---|
| Tempamine SCHEMBL50504 | 0.84 | CA1 (0.31) | — | |
| SCHEMBL6567906 | 0.74 | GAA (0.31) | — | |
| SCHEMBL2912919 | 0.71 | — | — | |
| SCHEMBL3785749 | 0.69 | ALDH1A1 (0.31) | — | |
| SCHEMBL6567479 | 0.69 | CYP11B2 (0.30) | — | |
| SCHEMBL6567505 | 0.69 | TSHR (0.44) | — | |
| SCHEMBL93390 | 0.69 | — | — | |
| SCHEMBL1486693 | 0.68 | — | — | |
| Hydroxyamine SCHEMBL12488720 | 0.68 | FFAR3 (0.30) | — | |
| SCHEMBL6567870 | 0.66 | ALOX15 (0.43) | — |
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.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-6265499-B1 | POLYMERIZING MIXTURE | MENICON CO., LTD. (JP) | 2001-07-24 | — | — | US | claimed |
| EP-0921134-B1 | Process for producing a shaped product | MENICON CO LTD (JP) | 2004-04-07 | — | — | EP | disclosed |
| US-6569968-B1 | Using polymerization catalyst | KURITA WATER INDUSTRIES LTD. (JP) | 2003-05-27 | — | — | US | disclosed |
| US-6265499-B1 | POLYMERIZING MIXTURE | MENICON CO., LTD. (JP) | 2001-07-24 | — | — | US | disclosed |
| EP-1077200-A2 | Polymer of a water-soluble radical-polymerizable monomer, process for producing the polymer and flocculant comprising the polymer | KURITA WATER INDUSTRIES LTD. (JP) | 2001-02-21 | — | — | EP | disclosed |
| EP-0921134-A1 | Process for producing a shaped product | Menicon Co., Ltd. (JP) | 1999-06-09 | — | — | EP | disclosed |