⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL5612392 | 0.93 | — | — | |
| SCHEMBL4844648 | 0.90 | ALDH1A1 (0.33) | — | |
| SCHEMBL17152113 | 0.71 | — | — | |
| SCHEMBL15019603 | 0.67 | — | — | |
| SCHEMBL2295003 | 0.67 | — | — | |
| SCHEMBL128862 | 0.65 | — | — | |
| SCHEMBL128566 | 0.65 | — | — | |
| SCHEMBL128423 | 0.65 | — | — | |
| SCHEMBL130891 | 0.65 | — | — | |
| SCHEMBL1153373 | 0.63 | — | — |
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-109422709-A | A kind of synthetic method of oxetanone | 柳州丰康泰科技有限公司 | 2019-03-05 | — | — | CN | disclosed |