⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL11230719 | 1.00 | — | — | |
| SCHEMBL5675269 | 1.00 | — | — | |
| SCHEMBL12561015 | 0.94 | CYP1A2 (0.50) | — | |
| SCHEMBL24151030 | 0.86 | — | — | |
| SCHEMBL6461247 | 0.80 | — | — | |
| SCHEMBL8686797 | 0.79 | CYP1A2 (0.48) | — | |
| SCHEMBL2651421 | 0.78 | — | — | |
| SCHEMBL11244232 | 0.75 | ALDH1A1 (0.42) | — | |
| SCHEMBL31351964 | 0.75 | CYP1A2 (0.40) | — | |
| SCHEMBL10593142 | 0.75 | — | — |
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 6 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-118184561-A | Synthetic method and application of R-N-methyl-2- (2-hydroxyethyl) pyrrolidine | 济宁晟泰药业有限公司 | 2024-06-14 | — | — | CN | claimed |
| CN-118184561-A | Synthetic method and application of R-N-methyl-2- (2-hydroxyethyl) pyrrolidine | 济宁晟泰药业有限公司 | 2024-06-14 | — | — | CN | disclosed |
| EP-1408030-B1 | NOVEL ALIPHATIC COMPOUND, METHOD OF SYNTHESIS, AND METHOD OF UTILIZATION | MARUHA CORP (JP) | 2006-01-04 | — | — | EP | disclosed |
| US-6949553-B2 | Aliphatic compounds, their synthesis method, and utilization of the same | MARUHA CORPORATION (JP) | 2005-09-27 | — | — | US | disclosed |
| US-20040162435-A1 | Novel aliphatic compound, method of synthesis, and method of utilization | MARUHA NICHIRO SEAFOODS, INC. (JP) | 2004-08-19 | — | — | US | disclosed |
| EP-1408030-A1 | NOVEL ALIPHATIC COMPOUND, METHOD OF SYNTHESIS, AND METHOD OF UTILIZATION | Maruha Corporation (JP) | 2004-04-14 | — | — | EP | disclosed |