⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL28051614 | 1.00 | — | — | |
| SCHEMBL8030877 | 1.00 | — | — | |
| SCHEMBL8354546 | 1.00 | — | — | |
| SCHEMBL27535585 | 0.87 | ADH1A (0.34) | — | |
| SCHEMBL27380311 | 0.87 | ADH1A (0.34) | — | |
| SCHEMBL9538517 | 0.79 | S1PR2 (0.44) | — | |
| SCHEMBL27619614 | 0.77 | — | — | |
| SCHEMBL27333654 | 0.77 | — | — | |
| SCHEMBL27758839 | 0.77 | — | — | |
| SCHEMBL11917908 | 0.77 | — | — |
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-109983007-A | Amide derivatives inhibitor and its preparation method and application | 江苏豪森药业集团有限公司 | 2019-07-05 | — | — | CN | disclosed |
| CN-109851610-A | Azabicyclo compound as muscarine M1 and/or M4 receptor stimulating agent | 赫普泰雅治疗有限公司 | 2019-06-07 | — | — | CN | disclosed |
| CN-106458986-B | Bicyclic aza compounds as muscarinic M1 and/or M4 receptor agonists | 赫普泰雅治疗有限公司 | 2019-01-04 | — | — | CN | disclosed |
| CN-107949384-A | Muscarinic agonists | 赫普泰雅治疗有限公司 | 2018-04-20 | — | — | CN | disclosed |
| CN-106458986-A | Bicyclic aza compounds as muscarinic M1 and/or M4 receptor agonists | 赫普泰雅治疗有限公司 | 2017-02-22 | — | — | CN | disclosed |