⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL29450218 | 0.87 | — | — | |
| SCHEMBL29683047 | 0.87 | — | — | |
| SCHEMBL28272949 | 0.87 | — | — | |
| SCHEMBL30074779 | 0.75 | — | — | |
| SCHEMBL30659785 | 0.75 | — | — | |
| SCHEMBL29871124 | 0.75 | — | — | |
| SCHEMBL9019660 | 0.75 | — | — | |
| SCHEMBL29493082 | 0.75 | — | — | |
| SCHEMBL13729106 | 0.71 | — | — | |
| SCHEMBL2427367 | 0.71 | — | — |
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-117960058-A | Two types of preparation methods and applications of metal aerogel | 温州大学 | 2024-05-03 | — | — | CN | disclosed |