⚠ 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 | |
|---|---|---|---|---|
| Hydrochloric Acid SCHEMBL27577750 | 0.79 | TDP1 (0.39) | — | |
| SCHEMBL2104293 | 0.71 | — | — | |
| SCHEMBL16877592 | 0.69 | ALDH1A1 (0.39) | — | |
| SCHEMBL29317582 | 0.69 | ALDH1A1 (0.39) | — | |
| SCHEMBL97511 | 0.67 | ADH1A (0.39) | — | |
| SCHEMBL23654646 | 0.65 | TDP1 (0.35) | — | |
| SCHEMBL18606950 | 0.65 | — | — | |
| SCHEMBL64029 | 0.64 | ADH1A (0.42) | — | |
| SCHEMBL14749889 | 0.63 | — | — | |
| SCHEMBL1929406 | 0.63 | — | — |
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-1846145-A1 | MIXING APPARATUS | Sumitomo Chemical Company, Limited (JP) | 2007-10-24 | — | — | EP | disclosed |
| WO-2006085666-A1 | MIXING APPARATUS | SUMITOMO CHEMICAL COMPANY, LIMITED (JP) | 2006-08-17 | — | — | WO | disclosed |
| EP-0975587-A1 | OXIME ETHER COMPOUNDS, THEIR USE AND INTERMEDIATES FOR PREPARATIONS OF THE SAME | SUMITOMO CHEMICAL COMPANY, LIMITED (JP) | 2000-02-02 | — | — | EP | disclosed |
| WO-1998043949-A1 | OXIME ETHER COMPOUNDS, THEIR USE AND INTERMEDIATES FOR PREPARATIONS OF THE SAME | SUMITOMO CHEMICAL COMPANY, LIMITED (JP) | 1998-10-08 | — | — | WO | disclosed |