⚠ 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 | |
|---|---|---|---|---|
| Arsenic SCHEMBL28289792 | 0.87 | — | — | |
| Arsenic SCHEMBL28075087 | 0.87 | — | — | |
| Arsenic SCHEMBL28044176 | 0.82 | — | — | |
| Arsenic SCHEMBL27925461 | 0.82 | — | — | |
| Arsenic SCHEMBL3794607 | 0.82 | — | — | |
| Arsenic SCHEMBL1138091 | 0.82 | — | — | |
| Arsenic SCHEMBL4176650 | 0.82 | — | — | |
| SCHEMBL901165 | 0.82 | — | — | |
| Arsenic SCHEMBL11113975 | 0.67 | — | — | |
| Arsenic SCHEMBL10359915 | 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-109663651-A | The separation system of cupric white cigarette dirt | 金隆铜业有限公司 | 2019-04-23 | — | — | CN | disclosed |