⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL4144582 | 0.65 | TRPA1 (0.46) | — | |
| SCHEMBL6676592 | 0.65 | TRPA1 (0.46) | — | |
| SCHEMBL4668984 | 0.65 | TERT (0.31) | — | |
| Sulfurous Acid SCHEMBL25287274 | 0.63 | — | — | |
| SCHEMBL27298582 | 0.63 | — | — | |
| Sulfurous Acid SCHEMBL6062465 | 0.61 | — | — | |
| Allylamine SCHEMBL7866713 | 0.61 | — | — | |
| Sulfurous Acid SCHEMBL9743525 | 0.61 | — | — | |
| Allylamine SCHEMBL11875810 | 0.61 | ALDH1A1 (0.60) | — | |
| Sulfurous Acid SCHEMBL6375651 | 0.61 | CA1 (0.40) | — |
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-115517353-A | Fermentation method of long-shelf-life fermented spicy cabbage | 徐州市金地杰农业发展有限公司 | 2022-12-27 | — | — | CN | disclosed |
| WO-2009082045-A1 | METHOD OF MANUFACTURING RICE OF LOWERING BLOOD GLUCOSE LEVELS BY USING ONIONS | HYUN DAI MEDICAL CO., LTD. (KR) | 2009-07-02 | — | — | WO | disclosed |