⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL12314688 | 0.83 | GRIN1 (0.31) | — | |
| SCHEMBL1788076 | 0.81 | — | — | |
| SCHEMBL1786776 | 0.77 | KCNH2 (0.32) | — | |
| SCHEMBL2331241 | 0.76 | JUN (0.30) | — | |
| SCHEMBL1788964 | 0.76 | DAO (0.46) | — | |
| SCHEMBL12314684 | 0.76 | SMN1; SMN2 (0.43) | — | |
| SCHEMBL14891389 | 0.73 | — | — | |
| SCHEMBL1790656 | 0.73 | DAO (0.40) | — | |
| SCHEMBL2810830 | 0.67 | KDM5B (0.32) | — | |
| SCHEMBL12314687 | 0.66 | DAO (0.40) | — |
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 9 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-8263628-B2 | Fluorine-containing organosulfur compound and pesticidal composition thereof | SUMITOMO CHEMICAL COMPANY, LIMITED. (JP) | 2012-09-11 | — | — | US | disclosed |
| US-8263628-B2 | Fluorine-containing organosulfur compound and pesticidal composition thereof | SUMITOMO CHEMICAL COMPANY, LIMITED. (JP) | 2012-09-11 | — | — | US | disclosed |
| US-8263628-B2 | Fluorine-containing organosulfur compound and pesticidal composition thereof | SUMITOMO CHEMICAL COMPANY, LIMITED. (JP) | 2012-09-11 | — | — | US | disclosed |
| US-20110124651-A1 | FLUORINE-CONTAINING ORGANOSULFUR COMPOUND AND PESTICIDAL COMPOSITION THEREOF | SUMITOMO CHEMICAL COMPANY, LIMITED. (JP) | 2011-05-26 | — | — | US | disclosed |
| US-20110124651-A1 | FLUORINE-CONTAINING ORGANOSULFUR COMPOUND AND PESTICIDAL COMPOSITION THEREOF | SUMITOMO CHEMICAL COMPANY, LIMITED. (JP) | 2011-05-26 | — | — | US | disclosed |
| US-20110124651-A1 | FLUORINE-CONTAINING ORGANOSULFUR COMPOUND AND PESTICIDAL COMPOSITION THEREOF | SUMITOMO CHEMICAL COMPANY, LIMITED. (JP) | 2011-05-26 | — | — | US | disclosed |
| CN-101835753-A | Fluorine-containing organosulfur compound and pesticidal composition thereof | SUMITOMO CHEMICAL CO | 2010-09-15 | — | — | CN | disclosed |
| EP-2181094-A1 | FLUORINE-CONTAINING ORGANOSULFUR COMPOUND AND PESTICIDAL COMPOSITION THEREOF | Sumitomo Chemical Company, Limited (JP) | 2010-05-05 | — | — | EP | disclosed |
| WO-2009025397-A1 | FLUORINE-CONTAINING ORGANOSULFUR COMPOUND AND PESTICIDAL COMPOSITION THEREOF | SUMITOMO CHEMICAL COMPANY, LIMITED (JP) | 2009-02-26 | — | — | WO | disclosed |