⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL10187886 | 0.57 | — | — | |
| SCHEMBL4458 | 0.56 | — | — | |
| Hydrochloric Acid SCHEMBL360708 | 0.54 | — | — | |
| SCHEMBL854885 | 0.54 | — | — | |
| Hydrochloric Acid SCHEMBL8681532 | 0.54 | — | — | |
| Water SCHEMBL4239659 | 0.54 | HSP90AA1 (0.93) | — | |
| Water SCHEMBL6705186 | 0.54 | — | — | |
| SCHEMBL9788062 | 0.51 | — | — | |
| Formaldehyde SCHEMBL3745731 | 0.50 | — | — | |
| Boric Acid SCHEMBL8843854 | 0.49 | HSP90AA1 (0.77) | — |
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-0057546-A2 | Sulfonylurea N-oxides | E.I. DU PONT DE NEMOURS AND COMPANY (US) | 1982-08-11 | — | — | EP | claimed |
| EP-0057546-A2 | Sulfonylurea N-oxides | E.I. DU PONT DE NEMOURS AND COMPANY (US) | 1982-08-11 | — | — | EP | disclosed |
| EP-0057546-A2 | Sulfonylurea N-oxides | E.I. DU PONT DE NEMOURS AND COMPANY (US) | 1982-08-11 | — | — | EP | disclosed |