⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL12942555 | 1.00 | — | — | |
| SCHEMBL129282 | 1.00 | — | — | |
| SCHEMBL2903696 | 0.83 | ALDH1A1 (0.46) | — | |
| SCHEMBL15434551 | 0.78 | — | — | |
| SCHEMBL20660 | 0.78 | — | — | |
| SCHEMBL741909 | 0.78 | — | — | |
| SCHEMBL1756097 | 0.78 | — | — | |
| SCHEMBL120668 | 0.78 | — | — | |
| SCHEMBL55475 | 0.78 | — | — | |
| Hydrogen Sulfide SCHEMBL15658769 | 0.74 | — | — |
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 7 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-8455674-B2 | Chlorothioformate manufacturing method | SUMITOMO CHEMICAL COMPANY, LIMITED (JP) | 2013-06-04 | — | — | US | disclosed |
| EP-2380875-A1 | CHLOROTHIOFORMATE MANUFACTURING METHOD | Sumitomo Chemical Company, Limited (JP) | 2011-10-26 | — | — | EP | disclosed |
| US-20110251429-A1 | CHLOROTHIOFORMATE MANUFACTURING METHOD | SUMITOMO CHEMICAL COMPANY, LIMITED (JP) | 2011-10-13 | — | — | US | disclosed |
| WO-2008157299-A9 | DIFFERENTIAL EXPRESSION PROFILING ANALYSIS OF CELL CULTURE PHENOTYPES AND USES THEREOF | WYETH CORP (US) | 2009-02-19 | — | — | WO | disclosed |
| WO-2008157299-A2 | DIFFERENTIAL EXPRESSION PROFILING ANALYSIS OF CELL CULTURE PHENOTYPES AND USES THEREOF | WYETH (US) | 2008-12-24 | — | — | WO | disclosed |
| US-4647585-A | Bicycloheptane substituted ethers | E. R. SQUIBB & SONS, INC. (US) | 1987-03-03 | — | — | US | disclosed |
| US-4608386-A | ASTHMA | E. R. SQUIBB & SONS, INC. (US) | 1986-08-26 | — | — | US | disclosed |