⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL6708530 | 0.97 | — | — | |
| SCHEMBL6708838 | 0.97 | — | — | |
| SCHEMBL225226 | 0.97 | — | — | |
| SCHEMBL28311617 | 0.95 | — | — | |
| SCHEMBL27821546 | 0.95 | — | — | |
| SCHEMBL28838392 | 0.95 | — | — | |
| Methylene Chloride SCHEMBL27774071 | 0.89 | — | — | |
| SCHEMBL27847154 | 0.83 | — | — | |
| SCHEMBL27731521 | 0.81 | — | — | |
| Pyrimidine SCHEMBL28279065 | 0.80 | SLC6A2 (0.32) | — |
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 1 patent. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-100509781-C | Process for preparing 1, 4-diphenylazetidinone derivatives | SANOFI AVENTIS DEUTSCHLAND (DE) | 2009-07-08 | — | — | CN | disclosed |