⚠ 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 | |
|---|---|---|---|---|
| Magnesium SCHEMBL29429237 | 0.82 | — | — | |
| Magnesium SCHEMBL29410392 | 0.82 | — | — | |
| Magnesium SCHEMBL30901039 | 0.82 | — | — | |
| Magnesium SCHEMBL30395906 | 0.82 | — | — | |
| Magnesium SCHEMBL29429238 | 0.82 | — | — | |
| Barium SCHEMBL29948041 | 0.82 | — | — | |
| Magnesium SCHEMBL31323657 | 0.71 | — | — | |
| Magnesium SCHEMBL31395664 | 0.71 | — | — | |
| Magnesium SCHEMBL31563824 | 0.71 | — | — | |
| SCHEMBL5167140 | 0.71 | — | — |
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-118026679-A | Method for preparing Ba (Mg 1/3Nb 2/3) O3 ceramic powders | 中科皓烨(东莞)材料科技有限责任公司 | 2024-05-14 | — | — | CN | disclosed |