⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL278498 | 1.00 | — | — | |
| SCHEMBL30951732 | 1.00 | — | — | |
| SCHEMBL16741959 | 1.00 | — | — | |
| SCHEMBL30414097 | 0.71 | — | — | |
| SCHEMBL23461961 | 0.00 | — | — | |
| SCHEMBL25435013 | 0.00 | — | — | |
| Hydrogen Sulfide SCHEMBL23805182 | 0.00 | — | — | |
| SCHEMBL23462080 | 0.00 | — | — | |
| SCHEMBL23462142 | 0.00 | — | — | |
| Hydrogen Sulfide SCHEMBL23805181 | 0.00 | — | — |
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-214880851-U | Industrial ultrapure water preparation device | 青岛美莱环境工程有限公司 | 2021-11-26 | — | — | CN | disclosed |