⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL8226967 | 0.87 | ESR1 (0.32) | — | |
| SCHEMBL13501610 | 0.87 | ESR1 (0.32) | — | |
| Iodide SCHEMBL5235454 | 0.86 | ESR1 (0.32) | — | |
| SCHEMBL13951014 | 0.86 | — | — | |
| SCHEMBL29597347 | 0.86 | ABCC2 (0.31) | — | |
| SCHEMBL304850 | 0.86 | ABCC2 (0.31) | — | |
| SCHEMBL12809139 | 0.85 | — | — | |
| SCHEMBL13764757 | 0.82 | CCNA2 (0.31) | — | |
| SCHEMBL13946392 | 0.80 | ESR1 (0.31) | — | |
| Iodide SCHEMBL5234153 | 0.77 | ESR1 (0.30) | — |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-7563901-B2 | Intermediates of 2-substituted carbapenem derivatives and process for production thereof | MEIJI SEIKA KAISHA, LTD. (JP) | 2009-07-21 | — | — | US | disclosed |
| US-20080167475-A1 | Intermediates of 2-substituted carbapenem derivatives and process for production thereof | SASAKI TOSHIRO | 2008-07-10 | — | — | US | disclosed |