⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL4851513 | 0.74 | — | — | |
| SCHEMBL11313820 | 0.74 | — | — | |
| SCHEMBL9826873 | 0.67 | — | — | |
| SCHEMBL6604941 | 0.67 | — | — | |
| SCHEMBL9857484 | 0.67 | — | — | |
| SCHEMBL8176837 | 0.67 | — | — | |
| SCHEMBL8176830 | 0.67 | — | — | |
| SCHEMBL3881 | 0.65 | — | — | |
| SCHEMBL9376 | 0.65 | — | — | |
| SCHEMBL14721530 | 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-0217108-A2 | Material preservative | BAYER AG (DE) | 1987-04-08 | — | — | EP | disclosed |
| EP-0213566-A2 | N-sulfenyl-benzene sulfon amides | BAYER AG (DE) | 1987-03-11 | — | — | EP | disclosed |