⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL19012585 | 0.79 | TSHR (0.38) | — | |
| SCHEMBL7715253 | 0.73 | — | — | |
| SCHEMBL844857 | 0.71 | — | — | |
| SCHEMBL4446396 | 0.71 | — | — | |
| SCHEMBL14261149 | 0.69 | TSHR (0.37) | — | |
| SCHEMBL28490317 | 0.69 | TSHR (0.38) | — | |
| SCHEMBL2104555 | 0.69 | — | — | |
| SCHEMBL28456688 | 0.69 | — | — | |
| SCHEMBL27991560 | 0.69 | — | — | |
| SCHEMBL12163447 | 0.67 | — | — |
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-109134716-B | Vanadium catalyst and method for preparing olefin polymer | 北京引发科技有限公司 | 2020-11-10 | — | — | CN | claimed |
| CN-109134716-B | Vanadium catalyst and method for preparing olefin polymer | 北京引发科技有限公司 | 2020-11-10 | — | — | CN | disclosed |