⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL19741477 | 0.81 | ALDH1A1 (0.38) | — | |
| SCHEMBL159060 | 0.81 | — | — | |
| SCHEMBL9070483 | 0.78 | — | — | |
| SCHEMBL27571672 | 0.73 | — | — | |
| SCHEMBL13847596 | 0.73 | — | — | |
| SCHEMBL7753331 | 0.73 | ALDH1A1 (0.39) | — | |
| SCHEMBL263198 | 0.73 | — | — | |
| SCHEMBL9421367 | 0.73 | — | — | |
| SCHEMBL7224478 | 0.72 | — | — | |
| SCHEMBL1301652 | 0.71 | — | — |
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 13 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-2321270-B1 | IMPROVED PROCESS FOR THE ADDITION OF THIOLATES TO ALFA, BETA-UNSATURATED CARBONYL OR SULFONYL COMPOUNDS | DOW AGROSCIENCES LLC (US) | 2016-03-23 | — | — | EP | disclosed |
| US-8513462-B2 | Pesticides and uses thereof | DOW AGROSCIENCES LLC (US) | 2013-08-20 | — | — | US | disclosed |
| US-20130012385-A1 | PESTICIDES AND USES THEREOF | DOW AGROSCIENCES LLC (US) | 2013-01-10 | — | — | US | disclosed |
| US-8288589-B2 | Pesticides and uses thereof | DOW AGROSCIENCES, LLC (US) | 2012-10-16 | — | — | US | disclosed |
| EP-2170066-B1 | PESTICIDES AND USES THEREOF | DOW AGROSCIENCES LLC (US) | 2012-02-29 | — | — | EP | disclosed |
| US-8101803-B2 | Process for the addition of thiolates to α,β-unsaturated carbonyl or sulfonyl compounds | DOW AGROSCIENCES LLC (US) | 2012-01-24 | — | — | US | disclosed |
| EP-2338334-A1 | Pesticides and uses thereof | Dow AgroSciences LLC (US) | 2011-06-29 | — | — | EP | disclosed |
| EP-2321270-A1 | IMPROVED PROCESS FOR THE ADDITION OF THIOLATES TO ALFA, BETA-UNSATURATED CARBONYL OR SULFONYL COMPOUNDS | Dow AgroSciences LLC (US) | 2011-05-18 | — | — | EP | disclosed |
| EP-2170066-A2 | PESTICIDES AND USES THEREOF | Dow AgroSciences LLC (US) | 2010-04-07 | — | — | EP | disclosed |
| WO-2010021855-A1 | IMPROVED PROCESS FOR THE ADDITION OF THIOLATES TO ALFA, BETA-UNSATURATED CARBONYL OR SULFONYL COMPOUNDS | DOW AGROSCIENCES LLC (US) | 2010-02-25 | — | — | WO | disclosed |
| US-20100048939-A1 | PROCESS FOR THE ADDITION OF THIOLATES TO ?,?-UNSATURATED CARBONYL OR SULFONYL COMPOUNDS | DOW AGROSCIENCES LLC (US) | 2010-02-25 | — | — | US | disclosed |
| WO-2009017951-A2 | PESTICIDES AND USES THEREOF | DOW AGROSCIENCES LLC (US) | 2009-02-05 | — | — | WO | disclosed |
| US-20090029863-A1 | PESTICIDES AND USES THEREOF | DOW AGROSCIENCES LLC (US) | 2009-01-29 | — | — | US | disclosed |