⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL9178661 | 0.69 | — | — | |
| SCHEMBL41850 | 0.57 | — | — | |
| SCHEMBL895297 | 0.53 | — | — | |
| SCHEMBL715733 | 0.53 | — | — | |
| SCHEMBL7497255 | 0.53 | — | — | |
| SCHEMBL25101253 | 0.52 | — | — | |
| SCHEMBL7508934 | 0.52 | — | — | |
| SCHEMBL12618209 | 0.52 | — | — | |
| SCHEMBL20925193 | 0.51 | — | — | |
| SCHEMBL1316573 | 0.49 | NOS1 (0.40) | — |
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 |
|---|---|---|---|---|---|---|---|
| US-4440919-A | CROSSLINKED WITH RESONANCE FREE DI(ALKENE TERTIARY AMINE) CYCLIC COMPOUNDS | BAUSCH & LOMB INCORPORATED (US) | 1984-04-03 | — | — | US | claimed |
| US-4436887-A | CONTACT LENSES, OXYGEN PERMEABILITY | BAUSCH & LOMB INCORPORATED (US) | 1984-03-13 | — | — | US | claimed |
| EP-0079720-A2 | Low n-vinyl lactam content-based biomedical devices and process for preparation thereof | BAUSCH & LOMB INCORPORATED (US) | 1983-05-25 | — | — | EP | claimed |
| EP-0079721-A2 | N-vinyl lactam-based biomedical devices and process for preparation thereof | BAUSCH & LOMB INCORPORATED (US) | 1983-05-25 | — | — | EP | claimed |
| US-4440919-A | CROSSLINKED WITH RESONANCE FREE DI(ALKENE TERTIARY AMINE) CYCLIC COMPOUNDS | BAUSCH & LOMB INCORPORATED (US) | 1984-04-03 | — | — | US | disclosed |
| US-4436887-A | CONTACT LENSES, OXYGEN PERMEABILITY | BAUSCH & LOMB INCORPORATED (US) | 1984-03-13 | — | — | US | disclosed |
| EP-0079721-A2 | N-vinyl lactam-based biomedical devices and process for preparation thereof | BAUSCH & LOMB INCORPORATED (US) | 1983-05-25 | — | — | EP | disclosed |
| EP-0079720-A2 | Low n-vinyl lactam content-based biomedical devices and process for preparation thereof | BAUSCH & LOMB INCORPORATED (US) | 1983-05-25 | — | — | EP | disclosed |