⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL29945078 | 1.00 | MGAM (0.53) | — | |
| SCHEMBL29629178 | 1.00 | — | — | |
| SCHEMBL2128645 | 0.95 | MGAM (0.56) | — | |
| SCHEMBL10389469 | 0.95 | MGAM (0.56) | — | |
| SCHEMBL1608 | 0.95 | — | — | |
| Water SCHEMBL23151837 | 0.91 | MGAM (0.53) | — | |
| SCHEMBL21404928 | 0.91 | — | — | |
| SCHEMBL9505534 | 0.91 | MGAM (0.53) | — | |
| SCHEMBL22325638 | 0.91 | — | — | |
| SCHEMBL21404935 | 0.91 | — | — |
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-4541791-A1 | DIHYDROOXADIAZINONE COMPOUND AND PHARMACEUTICAL USE THEREOF | Japan Tobacco Inc. (JP) | 2025-04-23 | — | — | EP | disclosed |
| US-20240101572-A1 | DIHYDROOXADIAZINONE COMPOUND AND PHARMACEUTICAL USE THEREOF | JAPAN TOBACCO INC. (JP) | 2024-03-28 | — | — | US | disclosed |
| WO-2023243686-A1 | DIHYDROOXADIAZINONE COMPOUND AND PHARMACEUTICAL USE THEREOF | 日本たばこ産業株式会社 | 2023-12-21 | — | — | WO | disclosed |
| US-20220144653-A1 | REDUCTION MATERIAL, COMPOSITE BODY AND REDUCTION METHOD | TOKYO INSTITUTE OF TECHNOLOGY (JP) | 2022-05-12 | — | — | US | disclosed |