⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL28939047 | 0.93 | — | — | |
| SCHEMBL28730752 | 0.93 | — | — | |
| SCHEMBL22363167 | 0.86 | — | — | |
| SCHEMBL9562037 | 0.84 | — | — | |
| SCHEMBL9139139 | 0.84 | — | — | |
| SCHEMBL7267996 | 0.84 | — | — | |
| SCHEMBL22439606 | 0.80 | — | — | |
| SCHEMBL23295955 | 0.77 | — | — | |
| SCHEMBL15542451 | 0.77 | — | — | |
| SCHEMBL7731797 | 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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-114405420-B | Nano high-entropy oxide aerogel and preparation method thereof | 西安建筑科技大学 | 2023-04-21 | — | — | CN | disclosed |
| CN-114405420-A | Nano high-entropy oxide aerogel and preparation method thereof | 西安建筑科技大学 | 2022-04-29 | — | — | CN | disclosed |