⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL8762117 | 0.71 | ALDH1A1 (0.36) | — | |
| SCHEMBL6265244 | 0.67 | — | — | |
| SCHEMBL9993481 | 0.65 | — | — | |
| SCHEMBL7173580 | 0.61 | — | — | |
| SCHEMBL5209750 | 0.57 | — | — | |
| SCHEMBL24709443 | 0.56 | — | — | |
| SCHEMBL18207753 | 0.56 | — | — | |
| SCHEMBL21145628 | 0.55 | — | — | |
| SCHEMBL16877972 | 0.54 | — | — | |
| SCHEMBL516333 | 0.52 | ALDH1A1 (0.42) | — |
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 5 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-5446173-A | Cyclic sulfide compound, polymerizable compositions for optical products and optical products formed thereof | DAISO CO., LTD. (JP) | 1995-08-29 | — | — | US | claimed |
| EP-0562966-B1 | A cyclic sulfide compound, polymerizable compositions for optical products and optical products formed thereof | DAISO CO LTD (JP) | 1997-05-07 | — | — | EP | disclosed |
| US-5484872-A | LENSES, FILTERS | DAISO CO., LTD. (JP) | 1996-01-16 | — | — | US | disclosed |
| US-5446173-A | Cyclic sulfide compound, polymerizable compositions for optical products and optical products formed thereof | DAISO CO., LTD. (JP) | 1995-08-29 | — | — | US | disclosed |
| EP-0562966-A2 | A cyclic sulfide compound, polymerizable compositions for optical products and optical products formed thereof | DAISO CO., LTD. (JP) | 1993-09-29 | — | — | EP | disclosed |