⚠ 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 | |
|---|---|---|---|---|
| Acetamide SCHEMBL28350256 | 0.85 | — | — | |
| Carbamic Acid SCHEMBL1682079 | 0.82 | — | — | |
| Urea SCHEMBL702965 | 0.82 | ALDH1A1 (0.30) | — | |
| Urea SCHEMBL702966 | 0.82 | ALDH1A1 (0.30) | — | |
| Urea SCHEMBL27371078 | 0.82 | ALDH1A1 (0.30) | — | |
| Acetone SCHEMBL4541424 | 0.80 | — | — | |
| Dimethylamine SCHEMBL28582435 | 0.79 | — | — | |
| SCHEMBL28633895 | 0.79 | — | — | |
| Acetic Acid SCHEMBL9630666 | 0.78 | FFAR3 (0.35) | — | |
| Bicarbonate SCHEMBL1563325 | 0.77 | — | — |
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 3 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-118159540-A | Novel capsid assembly inhibitor | 南韩商AM科学股份有限公司 | 2024-06-07 | — | — | CN | disclosed |
| CN-118159540-A | Novel capsid assembly inhibitor | 南韩商AM科学股份有限公司 | 2024-06-07 | — | — | CN | disclosed |
| CN-1600372-A | Medication carrier of perforating membrane peptide of bell protein | WANG ZHENGRONG (CN) | 2005-03-30 | — | — | CN | disclosed |