⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL5780961 | 0.94 | — | — | |
| SCHEMBL3394653 | 0.69 | — | — | |
| SCHEMBL19175616 | 0.62 | — | — | |
| SCHEMBL17859560 | 0.56 | — | — | |
| SCHEMBL7703054 | 0.48 | — | — | |
| SCHEMBL824748 | 0.48 | — | — | |
| SCHEMBL405874 | 0.44 | — | — | |
| SCHEMBL7086988 | 0.44 | — | — | |
| SCHEMBL12703368 | 0.44 | — | — | |
| SCHEMBL11891519 | 0.44 | — | — |
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-0066884-B1 | OXYGEN-ADSORBING AND DESORBING AGENT | TAIHO PHARMACEUTICAL CO., LTD. (JP) | 1986-05-14 | — | — | EP | disclosed |
| EP-0066884-A2 | Oxygen-adsorbing and desorbing agent | TAIHO PHARMACEUTICAL CO., LTD. (JP) | 1982-12-15 | — | — | EP | disclosed |