⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL8770825 | 0.74 | ALDH1A1 (0.33) | — | |
| SCHEMBL10701607 | 0.74 | — | — | |
| SCHEMBL20610131 | 0.67 | TSHR (0.30) | — | |
| SCHEMBL10826 | 0.67 | TSHR (0.43) | — | |
| SCHEMBL6865322 | 0.66 | — | — | |
| SCHEMBL275801 | 0.64 | — | — | |
| SCHEMBL22115646 | 0.64 | — | — | |
| SCHEMBL22442463 | 0.64 | — | — | |
| SCHEMBL868743 | 0.63 | ALDH1A1 (0.30) | — | |
| SCHEMBL1060683 | 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 8 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-1388540-B1 | ACRYLIC ESTERS AND USE THEREOF | MITSUI CHEMICALS INC (JP) | 2007-09-05 | — | — | EP | disclosed |
| US-6835844-B2 | Acrylic esters and use thereof | MITSUI CHEMICALS, INC. (JP) | 2004-12-28 | — | — | US | disclosed |
| US-20040102592-A1 | Acrylic esters and use thereof | MITSUI CHEMICALS, INC. (JP) | 2004-05-27 | — | — | US | disclosed |
| EP-1388540-A1 | ACRYLIC ESTERS AND USE THEREOF | Mitsui Chemicals, Inc. (JP) | 2004-02-11 | — | — | EP | disclosed |
| 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 |