⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL9807088 | 1.00 | — | — | |
| SCHEMBL1408472 | 0.86 | — | — | |
| SCHEMBL1408474 | 0.86 | — | — | |
| SCHEMBL2293948 | 0.83 | — | — | |
| SCHEMBL5420270 | 0.73 | — | — | |
| SCHEMBL2830982 | 0.73 | TRPA1 (0.33) | — | |
| SCHEMBL2833674 | 0.73 | TRPA1 (0.33) | — | |
| SCHEMBL2833644 | 0.73 | TRPA1 (0.33) | — | |
| SCHEMBL18383122 | 0.73 | — | — | |
| SCHEMBL730600 | 0.73 | TRPA1 (0.33) | — |
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-0246053-B1 | UNSATURATED SILYLATED VINYL ALCOHOL POLYMERS | E.I. DU PONT DE NEMOURS AND COMPANY (US) | 1991-05-15 | — | — | EP | disclosed |
| US-4739021-A | Unsaturated silylated vinyl alcohol polymers | E. I. DU PONT DE NEMOURS AND COMPANY (US) | 1988-04-19 | — | — | US | disclosed |
| EP-0246053-A1 | Unsaturated silylated vinyl alcohol polymers | E.I. DU PONT DE NEMOURS AND COMPANY (US) | 1987-11-19 | — | — | EP | disclosed |