⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL30403486 | 1.00 | — | — | |
| SCHEMBL2011124 | 0.80 | — | — | |
| SCHEMBL28445844 | 0.75 | DPP4 (0.31) | — | |
| SCHEMBL3680960 | 0.72 | CYP2D6 (0.48) | — | |
| SCHEMBL34189 | 0.71 | GABRA1 (0.33) | — | |
| SCHEMBL29381329 | 0.71 | GABRA1 (0.33) | — | |
| SCHEMBL30370579 | 0.70 | GABRA1 (0.34) | — | |
| SCHEMBL4444608 | 0.69 | BCHE (0.32) | — | |
| SCHEMBL5928468 | 0.69 | CYP2A6 (0.34) | — | |
| SCHEMBL28450466 | 0.68 | MAPT (0.33) | — |
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 14 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-116082157-A | Method for preparing organic carboxylic ester by olefine unsaturated compound alkoxycarbonyl reaction | 上海梓龄化工技术有限公司 | 2023-05-09 | — | — | CN | claimed |
| CN-116082157-A | Method for preparing organic carboxylic ester by olefine unsaturated compound alkoxycarbonyl reaction | 上海梓龄化工技术有限公司 | 2023-05-09 | — | — | CN | disclosed |
| CN-106928061-B | Continuous process for the carbonylation of ethylene | 璐彩特国际英国有限公司 | 2020-08-28 | — | — | CN | disclosed |
| EP-2794548-B1 | A CONTINUOUS PROCESS FOR THE CARBONYLATION OF ETHYLENE | LUCITE INT UK LTD (GB) | 2019-05-15 | — | — | EP | disclosed |
| EP-2794548-A1 | A CONTINUOUS PROCESS FOR THE CARBONYLATION OF ETHYLENE | Lucite International UK Limited (GB) | 2014-10-29 | — | — | EP | disclosed |
| WO-2013093472-A1 | A CONTINUOUS PROCESS FOR THE CARBONYLATION OF ETHYLENE | LUCITE INTERNATIONAL UK LIMITED (GB) | 2013-06-27 | — | — | WO | disclosed |
| US-20120309613-A1 | CARBONYLATION PROCESS | LUCITE INTERNATIONAL UK LIMITED (GB) | 2012-12-06 | — | — | US | disclosed |
| EP-2513031-A1 | A CONTINUOUS PROCESS FOR THE CARBONYLATION OF ETHYLENE | Lucite International UK Limited (GB) | 2012-10-24 | — | — | EP | disclosed |
| EP-2512670-A1 | IMPROVED CARBONYLATION PROCESS | Lucite International UK Limited (GB) | 2012-10-24 | — | — | EP | disclosed |
| WO-2011073653-A1 | IMPROVED CARBONYLATION PROCESS | LUCITE INTERNATIONAL UK LIMITED (GB) | 2011-06-23 | — | — | WO | disclosed |
| WO-2011073655-A1 | A CONTINUOUS PROCESS FOR THE CARBONYLATION OF ETHYLENE | LUCITE INTERNATIONAL UK LIMITED (GB) | 2011-06-23 | — | — | WO | disclosed |
| US-20100197958-A1 | PROCESS FOR THE CARBONYLATION OF AN ETHYLENICALLY UNSATURATED COMPOUND AND A CATALYST SYSTEM | LUCITE INTERNATIONAL UK LIMITED (GB) | 2010-08-05 | — | — | US | disclosed |
| EP-2167232-A1 | A PROCESS FOR THE CARBONYLATION OF AN ETHYLENICALLY UNSATURATED COMPOUND AND A CATALYST SYSTEM | Lucite International UK Limited (GB) | 2010-03-31 | — | — | EP | disclosed |
| WO-2009010782-A1 | A PROCESS FOR THE CARBONYLATION OF AN ETHYLENICALLY UNSATURATED COMPOUND AND A CATALYST SYSTEM | LUCITE INTERNATIONAL UK LIMITED (GB) | 2009-01-22 | — | — | WO | disclosed |