⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL3966144 | 1.00 | — | — | |
| SCHEMBL53064 | 1.00 | — | — | |
| SCHEMBL8855885 | 0.82 | — | — | |
| SCHEMBL11231202 | 0.82 | — | — | |
| SCHEMBL1833396 | 0.82 | — | — | |
| Charcoal, Activated SCHEMBL3215747 | 0.82 | — | — | |
| SCHEMBL8510895 | 0.82 | — | — | |
| Charcoal, Activated SCHEMBL7749920 | 0.82 | — | — | |
| SCHEMBL870844 | 0.82 | — | — | |
| SCHEMBL8617956 | 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-114037204-A | Comprehensive treatment and monitoring device and method based on coal gangue dump spontaneous combustion prevention | 山西宏鼎科技有限公司 | 2022-02-11 | — | — | CN | disclosed |