⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL50095 | 0.78 | — | — | |
| SCHEMBL7935098 | 0.69 | TSHR (0.30) | — | |
| SCHEMBL7485935 | 0.69 | TSHR (0.30) | — | |
| SCHEMBL2163734 | 0.67 | — | — | |
| SCHEMBL23506233 | 0.66 | — | — | |
| SCHEMBL987544 | 0.65 | TSHR (0.55) | — | |
| SCHEMBL13474854 | 0.63 | — | — | |
| SCHEMBL3456572 | 0.63 | — | — | |
| SCHEMBL1091610 | 0.62 | GAA (0.31) | — | |
| SCHEMBL1527690 | 0.62 | — | — |
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-1247793-B1 | Improved process for the manufacture of 2-ethylhexyl acrylate | ARKEMA FRANCE (FR) | 2008-01-09 | — | — | EP | claimed |
| EP-1247793-A1 | Improved process for the manufacture of 2-ethylhexyl acrylate | Atofina (FR) | 2002-10-09 | — | — | EP | claimed |
| EP-1247793-B1 | Improved process for the manufacture of 2-ethylhexyl acrylate | ARKEMA FRANCE (FR) | 2008-01-09 | — | — | EP | disclosed |
| EP-1247793-A1 | Improved process for the manufacture of 2-ethylhexyl acrylate | Atofina (FR) | 2002-10-09 | — | — | EP | disclosed |