⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL29290489 | 0.98 | — | — | |
| SCHEMBL14634943 | 0.82 | HSD17B10 (0.32) | — | |
| Tetrafluoroethylene SCHEMBL8664375 | 0.81 | ALDH1A1 (0.36) | — | |
| Trifluoroacetic Acid SCHEMBL10404726 | 0.79 | ALDH1A1 (0.32) | — | |
| SCHEMBL28263457 | 0.79 | ALDH1A1 (0.35) | — | |
| SCHEMBL28255663 | 0.79 | ALDH1A1 (0.35) | — | |
| Ethylene SCHEMBL10561806 | 0.78 | ALDH1A1 (0.42) | — | |
| Ethylene SCHEMBL994924 | 0.78 | ALDH1A1 (0.42) | — | |
| Ethylene SCHEMBL5527 | 0.78 | — | — | |
| Ethylene SCHEMBL10382764 | 0.78 | ALDH1A1 (0.42) | — |
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-110224040-A | A kind of self-cleaning solar opto-electronic board | 扬州市李伟照明电器有限公司 | 2019-09-10 | — | — | CN | disclosed |
| CN-109355789-A | Bamboo charcoal fibre face fabric and preparation method thereof | 南通薇星纺织科技有限公司 | 2019-02-19 | — | — | CN | disclosed |