⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL6910404 | 0.82 | — | — | |
| SCHEMBL1067397 | 0.82 | — | — | |
| SCHEMBL29572695 | 0.82 | — | — | |
| SCHEMBL3401539 | 0.82 | — | — | |
| SCHEMBL11767522 | 0.71 | — | — | |
| Hydrogen Sulfide SCHEMBL9448962 | 0.67 | — | — | |
| SCHEMBL11284871 | 0.67 | — | — | |
| SCHEMBL8657788 | 0.67 | — | — | |
| SCHEMBL5063470 | 0.67 | — | — | |
| SCHEMBL21175452 | 0.67 | — | — |
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-115888737-A | Cerium-cobalt composite oxygen carrier and preparation method and application thereof | 西北大学 | 2023-04-04 | — | — | CN | disclosed |