⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL10750646 | 0.89 | POLB (0.40) | — | |
| Ammonia Solution, Strong SCHEMBL10748205 | 0.89 | POLB (0.40) | — | |
| Ethane SCHEMBL6518950 | 0.84 | POLB (0.38) | — | |
| SCHEMBL9452590 | 0.82 | ALDH1A1 (0.44) | — | |
| SCHEMBL10829124 | 0.81 | — | — | |
| SCHEMBL9392223 | 0.79 | ALDH1A1 (0.42) | — | |
| SCHEMBL6208170 | 0.78 | POLB (0.33) | — | |
| SCHEMBL942983 | 0.76 | L3MBTL1 (0.43) | — | |
| SCHEMBL9819121 | 0.76 | POLB (0.42) | — | |
| SCHEMBL29840100 | 0.73 | CA1 (0.44) | — |
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 |
|---|---|---|---|---|---|---|---|
| EP-1056340-A1 | POTENTIATION OF BIOCIDE ACTIVITY USING A DIETHANOLAMIDE | BUCKMAN LABORATORIES INTERNATIONAL, INC. (US) | 2000-12-06 | — | — | EP | claimed |
| WO-1999043209-A1 | POTENTIATION OF BIOCIDE ACTIVITY USING A DIETHANOLAMIDE | BUCKMAN LABORATORIES INTERNATIONAL, INC. (US) | 1999-09-02 | — | — | WO | claimed |
| CN-109738563-B | Non-derivative detection method of ethylene bisdithiocarbamate pesticide | 华南农业大学 | 2021-12-17 | — | — | CN | disclosed |