⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL3754675 | 0.70 | — | — | |
| SCHEMBL14338115 | 0.70 | — | — | |
| SCHEMBL448088 | 0.68 | — | — | |
| SCHEMBL2714890 | 0.68 | — | — | |
| SCHEMBL4669075 | 0.68 | — | — | |
| SCHEMBL814045 | 0.68 | — | — | |
| SCHEMBL10753244 | 0.67 | — | — | |
| SCHEMBL3765747 | 0.67 | — | — | |
| SCHEMBL9061814 | 0.67 | — | — | |
| SCHEMBL18703908 | 0.65 | — | — |
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 1 patent. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-0114894-A1 | OXYGEN-PERMEABLE HARD CONTACT LENS | HOYA CORPORATION (JP) | 1984-08-08 | — | — | EP | claimed |