⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL28935068 | 0.91 | — | — | |
| SCHEMBL29054414 | 0.75 | APEX1 (0.30) | — | |
| SCHEMBL31325568 | 0.70 | — | — | |
| SCHEMBL28935008 | 0.68 | APEX1 (0.30) | — | |
| Ammonia Solution, Strong SCHEMBL28935136 | 0.68 | APEX1 (0.30) | — | |
| Hydrochloric Acid SCHEMBL29054337 | 0.66 | — | — | |
| SCHEMBL24619044 | 0.58 | — | — | |
| SCHEMBL23236762 | 0.57 | — | — | |
| SCHEMBL11034914 | 0.48 | — | — | |
| SCHEMBL50956 | 0.35 | — | — |
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 3 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-116349679-A | Composite disinfection and sterilization method | 孙国明 | 2023-06-30 | — | — | CN | claimed |
| CN-115433376-A | Preparation method of long-acting disinfection and sterilization fabric or fiber | 孙国明 | 2022-12-06 | — | — | CN | disclosed |
| WO-2021211411-A1 | DISINFECTANT COMPOSITIONS AND METHODS OF MAKING AND USING THE SAME | THE UNIVERSITY OF NORTH CAROLINA AT CHAPEL HILL (US) | 2021-10-21 | — | — | WO | disclosed |