⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL9682279 | 1.00 | — | — | |
| SCHEMBL9418383 | 1.00 | — | — | |
| SCHEMBL9681825 | 1.00 | — | — | |
| SCHEMBL28418342 | 1.00 | — | — | |
| SCHEMBL6037423 | 1.00 | — | — | |
| SCHEMBL6037401 | 1.00 | — | — | |
| SCHEMBL6037425 | 1.00 | — | — | |
| SCHEMBL9682286 | 1.00 | — | — | |
| SCHEMBL28425726 | 1.00 | — | — | |
| SCHEMBL6037343 | 1.00 | — | — |
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 |
|---|---|---|---|---|---|---|---|
| CN-111233916-A | Long carbon chain sulfur-containing silane coupling agent, and preparation method and application thereof | 南京曙光精细化工有限公司 | 2020-06-05 | — | — | CN | disclosed |
| EP-0491622-A1 | Novel organosilicon compound | SHIN-ETSU CHEMICAL CO., LTD. (JP) | 1992-06-24 | — | — | EP | disclosed |