⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL9417559 | 0.87 | — | — | |
| SCHEMBL28326613 | 0.87 | — | — | |
| SCHEMBL28136350 | 0.87 | — | — | |
| SCHEMBL28291096 | 0.87 | — | — | |
| SCHEMBL14857545 | 0.87 | — | — | |
| SCHEMBL300668 | 0.87 | — | — | |
| Methane SCHEMBL21433633 | 0.75 | — | — | |
| SCHEMBL9464290 | 0.75 | — | — | |
| SCHEMBL28348245 | 0.75 | — | — | |
| SCHEMBL28944258 | 0.75 | — | — |
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-206372681-U | The fluorine removal device of smoking gas containing fluorine in a kind of production for aluminium titanium boron | 山东滨州华创金属有限公司 | 2017-08-04 | — | — | CN | disclosed |