⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL1592582 | 0.78 | — | — | |
| SCHEMBL24092215 | 0.70 | — | — | |
| SCHEMBL5007375 | 0.66 | ALDH1A1 (0.62) | — | |
| SCHEMBL26969361 | 0.61 | ALDH1A1 (0.56) | — | |
| SCHEMBL1498110 | 0.61 | — | — | |
| Ethane SCHEMBL27695716 | 0.61 | — | — | |
| Chloromethane SCHEMBL4098077 | 0.61 | — | — | |
| SCHEMBL1562 | 0.61 | — | — | |
| Ethane SCHEMBL218028 | 0.61 | — | — | |
| SCHEMBL27337439 | 0.61 | KDM4E (0.56) | — |
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-1650214-B1 | Silicon compound | CHISSO CORP (JP) | 2009-11-04 | — | — | EP | disclosed |
| US-7256243-B2 | Silicon compound | CHISSO CORPORATION (JP) | 2007-08-14 | — | — | US | disclosed |
| EP-1650214-A2 | Silicon compound | CHISSO CORPORATION (JP) | 2006-04-26 | — | — | EP | disclosed |
| US-20050250925-A1 | Silicon compound | JNC CORPORATION (JP) | 2005-11-10 | — | — | US | disclosed |