⚠ 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 | |
|---|---|---|---|---|
| Phosphine SCHEMBL2689909 | 0.89 | — | — | |
| SCHEMBL8603083 | 0.89 | — | — | |
| SCHEMBL28584780 | 0.80 | — | — | |
| Water SCHEMBL28356694 | 0.80 | — | — | |
| SCHEMBL28607766 | 0.80 | — | — | |
| Hydrochloric Acid SCHEMBL28457810 | 0.80 | — | — | |
| SCHEMBL28560907 | 0.80 | — | — | |
| SCHEMBL8757 | 0.78 | — | — | |
| SCHEMBL906180 | 0.78 | — | — | |
| SCHEMBL11367292 | 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-113247939-A | Lutetium oxide and preparation method thereof | 江西明达功能材料有限责任公司 | 2021-08-13 | — | — | CN | disclosed |