⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL99501 | 0.82 | — | — | |
| Cesium SCHEMBL31611897 | 0.77 | — | — | |
| Methane SCHEMBL6275899 | 0.73 | — | — | |
| Hydrochloric Acid SCHEMBL10611875 | 0.73 | — | — | |
| SCHEMBL2248225 | 0.73 | — | — | |
| Ethane SCHEMBL11566789 | 0.67 | — | — | |
| Lithium SCHEMBL31213429 | 0.67 | — | — | |
| Lithium SCHEMBL31371224 | 0.67 | — | — | |
| Chloromethane SCHEMBL11788599 | 0.67 | — | — | |
| Cyclohexane SCHEMBL11258934 | 0.62 | — | — |
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-118580109-A | Preparation method of water-soluble potassium magnesium sulfate fertilizer | 国投新疆罗布泊钾盐有限责任公司 | 2024-09-03 | — | — | CN | disclosed |