⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL5560163 | 0.71 | — | — | |
| SCHEMBL14955239 | 0.68 | — | — | |
| SCHEMBL19943893 | 0.67 | — | — | |
| Diallylsulfone SCHEMBL9947 | 0.67 | — | — | |
| SCHEMBL780195 | 0.65 | — | — | |
| Diallylsulfone SCHEMBL17707262 | 0.64 | CA2 (0.31) | — | |
| Diallylsulfone SCHEMBL28961669 | 0.64 | CA2 (0.31) | — | |
| Diallylsulfone SCHEMBL9518459 | 0.64 | CA2 (0.31) | — | |
| SCHEMBL3259577 | 0.63 | — | — | |
| Acetic Acid SCHEMBL28513642 | 0.63 | ALDH1A1 (0.31) | — |
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 4 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-2602856-B1 | NONAQUEOUS ELECTROLYTE SOLUTION AND NONAQUEOUS ELECTROLYTE BATTERY USING SAME | WAKO PURE CHEM IND LTD (JP) | 2017-02-22 | — | — | EP | disclosed |
| US-9257720-B2 | Nonaqueous electrolyte solution and nonaqueous electrolyte battery using same | WAKO PURE CHEMICAL INDUSTRIES, LTD. (JP) | 2016-02-09 | — | — | US | disclosed |
| EP-2602856-A1 | NONAQUEOUS ELECTROLYTE SOLUTION AND NONAQUEOUS ELECTROLYTE BATTERY USING SAME | Wako Pure Chemical Industries, Ltd. (JP) | 2013-06-12 | — | — | EP | disclosed |
| US-20130130128-A1 | NONAQUEOUS ELECTROLYTE SOLUTION AND NONAQUEOUS ELECTROLYTE BATTERY USING SAME | WAKO PURE CHEMICAL INDUSTRIES, LTD. (JP) | 2013-05-23 | — | — | US | disclosed |