⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL29479633 | 1.00 | — | — | |
| SCHEMBL21880533 | 0.75 | MAOB (0.43) | — | |
| SCHEMBL23012630 | 0.75 | NISCH (0.36) | — | |
| SCHEMBL29479636 | 0.75 | NISCH (0.36) | — | |
| SCHEMBL29479788 | 0.70 | MEN1 (0.44) | — | |
| SCHEMBL23012169 | 0.70 | MEN1 (0.44) | — | |
| SCHEMBL28701660 | 0.69 | KMT2A (0.37) | — | |
| SCHEMBL13456762 | 0.65 | PGR (0.40) | — | |
| SCHEMBL29547314 | 0.64 | — | — | |
| SCHEMBL688866 | 0.64 | — | — |
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 |
|---|---|---|---|---|---|---|---|
| CN-114269725-A | Anti-influenza virus compound and preparation method and application thereof | 四川海思科制药有限公司 | 2022-04-01 | — | — | CN | disclosed |