⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL574042 | 0.77 | MAPT (1.00) | — | |
| SCHEMBL29354111 | 0.77 | MAPT (1.00) | — | |
| SCHEMBL304890 | 0.77 | MAPT (0.68) | — | |
| SCHEMBL131175 | 0.77 | MAPT (1.00) | — | |
| SCHEMBL29710671 | 0.74 | MAPT (0.94) | — | |
| SCHEMBL27424712 | 0.74 | MAPT (0.94) | — | |
| SCHEMBL625151 | 0.74 | MAPT (0.94) | — | |
| SCHEMBL27424715 | 0.74 | MAPT (0.94) | — | |
| SCHEMBL6707273 | 0.74 | MAPT (0.94) | — | |
| SCHEMBL3774226 | 0.72 | — | — |
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 4 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-115340581-B | Synthesis method and application of o-phenol sulfenamide on-DNA compound | 深圳市小分子新药创新中心有限公司 | 2023-02-03 | — | — | CN | disclosed |
| CN-115340581-A | Synthesis method and application of o-phenol sulfenamide on-DNA compound | 深圳市小分子新药创新中心有限公司 | 2022-11-15 | — | — | CN | disclosed |
| CN-113980077-B | Synthesis method and application of on-DNA (deoxyribonucleic acid) o-phenol sulfilimine compound | 深圳市小分子新药创新中心有限公司 | 2022-05-17 | — | — | CN | disclosed |
| CN-113980077-A | Synthesis method and application of on-DNA (deoxyribonucleic acid) o-phenol sulfilimine compound | 深圳市小分子新药创新中心有限公司 | 2022-01-28 | — | — | CN | disclosed |