⚠ 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 | |
|---|---|---|---|---|
| Hydrochloric Acid SCHEMBL27896174 | 0.96 | — | — | |
| Charcoal, Activated SCHEMBL874619 | 0.91 | — | — | |
| Hydrogen Peroxide SCHEMBL27500303 | 0.87 | — | — | |
| SCHEMBL28231825 | 0.87 | — | — | |
| SCHEMBL13282 | 0.87 | — | — | |
| SCHEMBL8166671 | 0.87 | — | — | |
| SCHEMBL28427859 | 0.83 | — | — | |
| SCHEMBL25412608 | 0.82 | — | — | |
| Ammonia Solution, Strong SCHEMBL8404229 | 0.82 | — | — | |
| Water SCHEMBL6727001 | 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 |
|---|---|---|---|---|---|---|---|
| EP-1576073-B1 | FIRE RESISTANT MATERIAL | COMMW SCIENT IND RES ORG (AU) | 2012-02-15 | — | — | EP | disclosed |