⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL28891790 | 0.83 | — | — | |
| SCHEMBL28686147 | 0.76 | — | — | |
| SCHEMBL10453086 | 0.76 | — | — | |
| SCHEMBL9863090 | 0.75 | TSHR (0.42) | — | |
| SCHEMBL10453084 | 0.75 | TSHR (0.42) | — | |
| SCHEMBL440260 | 0.72 | — | — | |
| SCHEMBL26071568 | 0.70 | — | — | |
| SCHEMBL3362081 | 0.69 | ALDH1A1 (0.31) | — | |
| SCHEMBL6664987 | 0.65 | — | — | |
| Isopropyl Alcohol SCHEMBL27490215 | 0.64 | ALDH1A1 (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 1 patent. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-115232168-A | Preparation method of fosfomycin methoxyl ring-opening impurity | 深圳鼎邦生物科技有限公司 | 2022-10-25 | — | — | CN | disclosed |