⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL1397121 | 0.77 | — | — | |
| SCHEMBL5973062 | 0.75 | POLB (0.33) | — | |
| SCHEMBL30542025 | 0.66 | — | — | |
| Glycolic Acid SCHEMBL19615736 | 0.66 | NOTUM (0.33) | — | |
| SCHEMBL28286560 | 0.66 | KCNH2 (0.33) | — | |
| Succinic Acid SCHEMBL22691726 | 0.66 | NPSR1 (0.39) | — | |
| Glycolic Acid SCHEMBL28396238 | 0.66 | NOTUM (0.33) | — | |
| SCHEMBL15780500 | 0.65 | — | — | |
| Lactic Acid SCHEMBL28398200 | 0.65 | TP53 (0.42) | — | |
| SCHEMBL9253272 | 0.65 | PPM1B (0.34) | — |
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-116396118-A | Fertilizer preparation for improving selenium content of agricultural products, preparation method and application thereof | 广州优卡思农业技术有限公司 | 2023-07-07 | — | — | CN | claimed |
| CN-117534528-A | Environment-friendly compound fertilizer | 宁夏大彩生物科技有限公司 | 2024-02-09 | — | — | CN | disclosed |
| CN-116396124-A | Slow-release fertilizer suitable for Hainan brick red soil | 中国热带农业科学院环境与植物保护研究所 | 2023-07-07 | — | — | CN | disclosed |