⚠ 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 | |
|---|---|---|---|---|
| Ethylene SCHEMBL10955207 | 1.00 | — | — | |
| Ammonia Solution, Strong SCHEMBL9098311 | 0.94 | — | — | |
| SCHEMBL96445 | 0.90 | — | — | |
| SCHEMBL5158148 | 0.87 | — | — | |
| SCHEMBL8371774 | 0.87 | — | — | |
| SCHEMBL7753671 | 0.87 | — | — | |
| SCHEMBL7929828 | 0.87 | — | — | |
| Ethyl Hydrogen Phosphonate SCHEMBL28723084 | 0.75 | — | — | |
| Ethylene SCHEMBL5160390 | 0.75 | — | — | |
| Ethylene SCHEMBL22264613 | 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 |
|---|---|---|---|---|---|---|---|
| WO-1996001309-A1 | BLEACHING COMPOSITIONS | WARWICK INTERNATIONAL GROUP LIMITED (GB) | 1996-01-18 | — | — | WO | disclosed |