⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL15392072 | 0.80 | — | — | |
| SCHEMBL2034087 | 0.79 | — | — | |
| SCHEMBL1045069 | 0.78 | — | — | |
| SCHEMBL9411485 | 0.78 | — | — | |
| SCHEMBL1046020 | 0.78 | — | — | |
| SCHEMBL396760 | 0.78 | — | — | |
| SCHEMBL393243 | 0.76 | — | — | |
| SCHEMBL396531 | 0.76 | — | — | |
| SCHEMBL9820065 | 0.76 | — | — | |
| SCHEMBL332508 | 0.73 | — | — |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-0640221-A1 | SURFACE WETTABLE SILICONE HYDROGELS. | BAUSCH & LOMB (US) | 1995-03-01 | — | — | EP | claimed |
| WO-1993023774-A1 | SURFACE WETTABLE SILICONE HYDROGELS | BAUSCH & LOMB INCORPORATED (US) | 1993-11-25 | — | — | WO | claimed |