⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL1095388 | 0.91 | — | — | |
| SCHEMBL7114758 | 0.86 | CA2 (0.30) | — | |
| SCHEMBL18940535 | 0.84 | ALDH1A1 (0.31) | — | |
| SCHEMBL5586705 | 0.83 | — | — | |
| SCHEMBL28429657 | 0.83 | — | — | |
| SCHEMBL991537 | 0.83 | APP (0.38) | — | |
| SCHEMBL18940694 | 0.78 | — | — | |
| SCHEMBL329186 | 0.77 | — | — | |
| SCHEMBL315210 | 0.77 | — | — | |
| SCHEMBL28783562 | 0.77 | APP (0.37) | — |
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 6 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-8153717-B2 | Rubber composition | SHIRAISHI KOGYO KAISHA, LTD. (JP) | 2012-04-10 | — | — | US | disclosed |
| EP-1785452-B1 | POWDERY WHITE VULCANIZATION PROMOTER COMPOSITION AND RUBBER COMPOSITIONS | SHIRAISHI KOGYO KAISHA LTD (JP) | 2011-03-02 | — | — | EP | disclosed |
| US-7776232-B2 | Modified calcium carbonate surface-treated with a fatty acid and silicic acid or a rosin and silicic acid; an inorganic filler exhibiting an oil absorption, and a vulcanization promoter liquid at ordinary temperatures; storage stability; excellent in resistance to heat build-up; designability | SHIRAISHI KOGYO KAISHA, LTD. (JP) | 2010-08-17 | — | — | US | disclosed |
| US-20100160500-A1 | Rubber composition | KORENAGA TAKASHI | 2010-06-24 | — | — | US | disclosed |
| US-20070293621-A1 | Modified calcium carbonate surface-treated with a fatty acid and silicic acid or a rosin and silicic acid; an inorganic filler exhibiting an oil absorption, and a vulcanization promoter liquid at ordinary temperatures; storage stability; excellent in resistance to heat build-up; designability | SHIRAISHI KOGYO KAISHA, LTD. (JP) | 2007-12-20 | — | — | US | disclosed |
| EP-1785452-A1 | POWDERY WHITE VULCANIZATION PROMOTER COMPOSITION AND RUBBER COMPOSITIONS | Shiraishi Kogyo Kaisha, Ltd. (JP) | 2007-05-16 | — | — | EP | disclosed |