⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL28460983 | 0.89 | — | — | |
| Hydrogen Sulfide SCHEMBL27789793 | 0.89 | — | — | |
| SCHEMBL27854876 | 0.87 | — | — | |
| SCHEMBL27917060 | 0.87 | — | — | |
| SCHEMBL27814152 | 0.87 | — | — | |
| SCHEMBL4800145 | 0.87 | — | — | |
| SCHEMBL106069 | 0.87 | — | — | |
| SCHEMBL28620261 | 0.87 | — | — | |
| SCHEMBL20815499 | 0.87 | — | — | |
| SCHEMBL28862866 | 0.82 | — | — |
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-108311128-B | Application of low-temperature liquid metal microspheres in preparation of organic polymer monolithic chromatographic column | 河南科技学院 | 2021-02-09 | — | — | CN | claimed |