⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL576858 | 0.64 | — | — | |
| SCHEMBL584048 | 0.64 | — | — | |
| SCHEMBL7382291 | 0.59 | — | — | |
| SCHEMBL4457892 | 0.59 | — | — | |
| SCHEMBL20712750 | 0.59 | TSHR (0.35) | — | |
| SCHEMBL1057976 | 0.59 | — | — | |
| SCHEMBL22025657 | 0.59 | TSHR (0.35) | — | |
| SCHEMBL22025062 | 0.59 | TSHR (0.35) | — | |
| SCHEMBL9620231 | 0.59 | — | — | |
| SCHEMBL421978 | 0.59 | — | — |
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 8 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-1229032-B1 | 1,3-oxathianes as perfuming and flavouring ingredients | FIRMENICH & CIE (CH) | 2005-04-20 | — | — | EP | claimed |
| US-6559109-B2 | 4,4-dialkyl- or dialkenyl- substituted; perfumed soaps, shower or bath gels, shampoos, body deodorants and antiperspirants, ambient air deodorants, liquid or solid detergents for textile or dishes | FIRMENICH SA (CH) | 2003-05-06 | — | — | US | claimed |
| US-20020155960-A1 | 1,3-Oxathianes as perfuming and flavoring ingredients | FIRMENICH SA (CH) | 2002-10-24 | — | — | US | claimed |
| EP-1229032-A2 | 1,3-oxathianes as perfuming and flavouring ingredients | FIRMENICH SA (CH) | 2002-08-07 | — | — | EP | claimed |
| EP-1229032-B1 | 1,3-oxathianes as perfuming and flavouring ingredients | FIRMENICH & CIE (CH) | 2005-04-20 | — | — | EP | disclosed |
| US-6559109-B2 | 4,4-dialkyl- or dialkenyl- substituted; perfumed soaps, shower or bath gels, shampoos, body deodorants and antiperspirants, ambient air deodorants, liquid or solid detergents for textile or dishes | FIRMENICH SA (CH) | 2003-05-06 | — | — | US | disclosed |
| US-20020155960-A1 | 1,3-Oxathianes as perfuming and flavoring ingredients | FIRMENICH SA (CH) | 2002-10-24 | — | — | US | disclosed |
| EP-1229032-A2 | 1,3-oxathianes as perfuming and flavouring ingredients | FIRMENICH SA (CH) | 2002-08-07 | — | — | EP | disclosed |