⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL11405642 | 0.78 | DRD2 (0.34) | — | |
| SCHEMBL28030268 | 0.74 | SLC6A2 (0.30) | — | |
| SCHEMBL25176293 | 0.72 | DRD2 (0.32) | — | |
| SCHEMBL1692034 | 0.70 | — | — | |
| SCHEMBL17479092 | 0.70 | CCR5 (0.38) | — | |
| SCHEMBL22652946 | 0.70 | — | — | |
| SCHEMBL16877514 | 0.70 | — | — | |
| SCHEMBL16877913 | 0.70 | CCR5 (0.38) | — | |
| SCHEMBL23745320 | 0.70 | — | — | |
| SCHEMBL16878781 | 0.70 | DRD2 (0.31) | — |
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 5 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-111039887-A | Stable isotope labeled furaltadone metabolite and synthetic method thereof | 上海安谱实验科技股份有限公司 | 2020-04-21 | — | — | CN | claimed |
| CN-103420934-A | Synthesis method of 5- methylmorpholine-3-amino-2-oxazolidinyl ketone | UNIV HUAZHONG AGRICULTURAL | 2013-12-04 | — | — | CN | claimed |
| CN-111039887-A | Stable isotope labeled furaltadone metabolite and synthetic method thereof | 上海安谱实验科技股份有限公司 | 2020-04-21 | — | — | CN | disclosed |
| CN-111039887-A | Stable isotope labeled furaltadone metabolite and synthetic method thereof | 上海安谱实验科技股份有限公司 | 2020-04-21 | — | — | CN | disclosed |
| CN-103420934-A | Synthesis method of 5- methylmorpholine-3-amino-2-oxazolidinyl ketone | UNIV HUAZHONG AGRICULTURAL | 2013-12-04 | — | — | CN | disclosed |