⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL5201096 | 0.97 | — | — | |
| Ethane SCHEMBL4755795 | 0.94 | — | — | |
| SCHEMBL9716096 | 0.75 | — | — | |
| SCHEMBL10777180 | 0.75 | — | — | |
| SCHEMBL29045333 | 0.73 | ELANE (0.36) | — | |
| SCHEMBL6910170 | 0.73 | — | — | |
| SCHEMBL6354724 | 0.71 | — | — | |
| SCHEMBL28333588 | 0.71 | — | — | |
| SCHEMBL28738930 | 0.71 | — | — | |
| SCHEMBL11013587 | 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-109666792-B | Rare earth extractant and method for separating rare earth yttrium | 厦门熙途科技有限公司 | 2020-12-01 | — | — | CN | disclosed |