⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL1729752 | 0.72 | ALDH1A1 (0.30) | — | |
| SCHEMBL28154960 | 0.72 | ALDH1A1 (0.30) | — | |
| SCHEMBL9186867 | 0.72 | ALDH1A1 (0.30) | — | |
| SCHEMBL665769 | 0.72 | ALDH1A1 (0.30) | — | |
| Ammonia Solution, Strong SCHEMBL1144098 | 0.70 | — | — | |
| Helium SCHEMBL29280587 | 0.70 | — | — | |
| SCHEMBL15562956 | 0.70 | TSHR (0.35) | — | |
| Ethylene SCHEMBL1405717 | 0.68 | — | — | |
| SCHEMBL27164818 | 0.68 | — | — | |
| SCHEMBL11021177 | 0.68 | — | — |
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 |
|---|---|---|---|---|---|---|---|
| CN-118085802-A | Single-component ketoxime-removing silicone sealant containing sulfhydryl-amino and preparation method thereof | 广州白云科技股份有限公司 | 2024-05-28 | — | — | CN | claimed |
| CN-118085802-A | Single-component ketoxime-removing silicone sealant containing sulfhydryl-amino and preparation method thereof | 广州白云科技股份有限公司 | 2024-05-28 | — | — | CN | disclosed |
| CN-118085802-A | Single-component ketoxime-removing silicone sealant containing sulfhydryl-amino and preparation method thereof | 广州白云科技股份有限公司 | 2024-05-28 | — | — | CN | disclosed |