⚠ 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 | |
|---|---|---|---|---|
| Calcium SCHEMBL30513664 | 0.89 | — | — | |
| Calcium SCHEMBL30679495 | 0.89 | — | — | |
| Calcium SCHEMBL32685205 | 0.89 | — | — | |
| Calcium SCHEMBL31268479 | 0.80 | — | — | |
| Calcium SCHEMBL30495968 | 0.78 | — | — | |
| Calcium SCHEMBL32670835 | 0.78 | — | — | |
| Magnesium SCHEMBL31388379 | 0.78 | — | — | |
| Calcium SCHEMBL31454833 | 0.78 | — | — | |
| Calcium SCHEMBL30645773 | 0.78 | — | — | |
| Magnesium SCHEMBL29372637 | 0.78 | — | — |
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-121651904-A | Lutetium calcium magnesium aluminum silica garnet transparent ceramic material and application thereof in white light LED | 华南理工大学 | 2026-03-13 | — | — | CN | disclosed |