⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL2107266 | 0.77 | — | — | |
| SCHEMBL7324593 | 0.74 | — | — | |
| SCHEMBL11608061 | 0.74 | — | — | |
| SCHEMBL16409261 | 0.72 | — | — | |
| SCHEMBL6542865 | 0.70 | — | — | |
| SCHEMBL10378067 | 0.70 | — | — | |
| SCHEMBL9636001 | 0.69 | — | — | |
| SCHEMBL1694963 | 0.67 | — | — | |
| SCHEMBL7317695 | 0.67 | — | — | |
| SCHEMBL11613821 | 0.65 | — | — |
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 2 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 |