⚠ 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 | |
|---|---|---|---|---|
| Ethylene SCHEMBL29631732 | 0.97 | — | — | |
| SCHEMBL7529535 | 0.97 | ALDH1A1 (0.44) | — | |
| SCHEMBL1438 | 0.97 | — | — | |
| Water SCHEMBL404087 | 0.94 | — | — | |
| Ethylene SCHEMBL10382764 | 0.94 | ALDH1A1 (0.42) | — | |
| SCHEMBL25416150 | 0.94 | — | — | |
| SCHEMBL1919359 | 0.94 | — | — | |
| SCHEMBL21776861 | 0.94 | — | — | |
| SCHEMBL7064953 | 0.94 | — | — | |
| Ethylene SCHEMBL5527 | 0.94 | — | — |
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-119237747-A | Method for preparing Cu/CuO nano sheet bundle by hydrothermal reduction | 哈尔滨工业大学(深圳)(哈尔滨工业大学深圳科技创新研究院) | 2025-01-03 | — | — | CN | claimed |
| CN-1134444-C | Epothilone analogs and pharmaceutical compositions thereof | 普罗格特-甘布尔公司 | 2004-01-14 | — | — | CN | disclosed |
| CN-1246862-A | Epothilone analogs | NOVARTIS AG (CH) | 2000-03-08 | — | — | CN | disclosed |