⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL28026111 | 0.79 | — | — | |
| SCHEMBL1059901 | 0.76 | — | — | |
| SCHEMBL28878222 | 0.76 | — | — | |
| SCHEMBL13292575 | 0.76 | — | — | |
| SCHEMBL24385063 | 0.73 | — | — | |
| SCHEMBL37011 | 0.72 | — | — | |
| SCHEMBL10973653 | 0.71 | — | — | |
| SCHEMBL7598835 | 0.71 | — | — | |
| SCHEMBL28576758 | 0.71 | — | — | |
| SCHEMBL6666960 | 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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-104231119-B | A kind of preparation method of long chain branching high-cis polybutadiene | SINOPEC CORP. (CN) | 2016-05-11 | — | — | CN | claimed |
| CN-104231119-B | A kind of preparation method of long chain branching high-cis polybutadiene | SINOPEC CORP. (CN) | 2016-05-11 | — | — | CN | disclosed |