⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL23722755 | 0.94 | — | — | |
| SCHEMBL196807 | 0.89 | — | — | |
| SCHEMBL3423283 | 0.87 | — | — | |
| SCHEMBL75686 | 0.82 | — | — | |
| SCHEMBL2048151 | 0.79 | — | — | |
| Hexane SCHEMBL27886879 | 0.79 | CETP (0.31) | — | |
| Decane SCHEMBL27561797 | 0.78 | CETP (0.32) | — | |
| SCHEMBL28295708 | 0.78 | — | — | |
| SCHEMBL21248033 | 0.77 | — | — | |
| SCHEMBL28295568 | 0.76 | — | — |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-109715680-A | The method for preparing high-cis -1,4- polydiene with the carbon monoxide-olefin polymeric based on lanthanide series | 株式会社普利司通 | 2019-05-03 | — | — | CN | claimed |
| CN-109715680-A | The method for preparing high-cis -1,4- polydiene with the carbon monoxide-olefin polymeric based on lanthanide series | 株式会社普利司通 | 2019-05-03 | — | — | CN | disclosed |