⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL28423795 | 1.00 | — | — | |
| SCHEMBL28424191 | 1.00 | — | — | |
| SCHEMBL28423736 | 1.00 | — | — | |
| SCHEMBL28425742 | 1.00 | — | — | |
| SCHEMBL28421150 | 0.98 | — | — | |
| SCHEMBL376198 | 0.91 | — | — | |
| SCHEMBL13430610 | 0.89 | — | — | |
| SCHEMBL704524 | 0.86 | — | — | |
| SCHEMBL28418738 | 0.83 | — | — | |
| SCHEMBL28428160 | 0.83 | — | — |
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 1 patent. 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 |