⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL1900684 | 0.82 | — | — | |
| SCHEMBL1536274 | 0.77 | — | — | |
| SCHEMBL1900146 | 0.73 | — | — | |
| SCHEMBL1991239 | 0.69 | — | — | |
| SCHEMBL1989744 | 0.69 | — | — | |
| SCHEMBL1996496 | 0.65 | — | — | |
| SCHEMBL8499399 | 0.65 | — | — | |
| SCHEMBL1899022 | 0.65 | — | — | |
| SCHEMBL1901614 | 0.65 | — | — | |
| SCHEMBL28461518 | 0.65 | — | — |
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-107445794-B | Method for preparing halogenated five-membered cyclic olefin by gas phase isomerization reaction | 北京宇极科技发展有限公司 | 2020-12-04 | — | — | CN | disclosed |