⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL17055166 | 1.00 | — | — | |
| SCHEMBL16748400 | 1.00 | — | — | |
| SCHEMBL12834847 | 0.82 | — | — | |
| SCHEMBL22986823 | 0.80 | DPP4 (0.31) | — | |
| SCHEMBL23092026 | 0.80 | — | — | |
| SCHEMBL24435728 | 0.73 | — | — | |
| SCHEMBL24435757 | 0.73 | — | — | |
| SCHEMBL24867899 | 0.73 | — | — | |
| SCHEMBL16386240 | 0.71 | — | — | |
| SCHEMBL22986789 | 0.69 | KDM4E (0.33) | — |
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 4 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-20120046455-A1 | Catalytic Cyclopropanation of Alkenes with Alpha-Cyano-Diazoacetates | NATIONAL SCIENCE FOUNDATION | 2012-02-23 | — | — | US | disclosed |
| US-20100317698-A1 | Polysubstituted Pyridinylaminoalkylene- and Pyridinyloxyalkylene-Cyclopropanamine Compounds, a Process for Their Preparation and Pharmaceutical Compositions Containing Them | LES LABORATOIRES SERVIER (FR) | 2010-12-16 | — | — | US | disclosed |
| CN-100345974-C | Microbiological preparation method of S-(+)-2,2-dimethyl cyclo propyl formamide | UNIV ZHEJIANG POLYTECHNIC (CN) | 2007-10-31 | — | — | CN | disclosed |
| CN-1786179-A | Microbiological preparation method of S-(+)-2,2-dimethyl cyclo propyl formamide | UNIV ZHEJIANG POLYTECHNIC (CN) | 2006-06-14 | — | — | CN | disclosed |