⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL7883346 | 0.68 | — | — | |
| SCHEMBL3616997 | 0.64 | — | — | |
| SCHEMBL1399779 | 0.64 | — | — | |
| SCHEMBL2224043 | 0.62 | — | — | |
| SCHEMBL300712 | 0.61 | — | — | |
| SCHEMBL2635436 | 0.61 | — | — | |
| SCHEMBL3046113 | 0.61 | — | — | |
| SCHEMBL22493915 | 0.61 | — | — | |
| SCHEMBL4432693 | 0.60 | — | — | |
| SCHEMBL23363809 | 0.59 | — | — |
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-114401968-A | Novel heterocyclic monoacylglycerol lipase (MAGL) inhibitors | 豪夫迈·罗氏有限公司 | 2022-04-26 | — | — | CN | disclosed |
| WO-2015040406-A2 | AGRICULTURAL CHEMICALS | REDX PHARMA LIMITED (GB) | 2015-03-26 | — | — | WO | disclosed |