⚠ 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 | |
|---|---|---|---|---|
| Trifluoromethanesulfonic Acid SCHEMBL5238034 | 0.90 | ESR1 (0.32) | — | |
| SCHEMBL5230583 | 0.90 | ABCC2 (0.31) | — | |
| Iodide SCHEMBL5232575 | 0.83 | CACNA1C (0.30) | — | |
| SCHEMBL5235538 | 0.83 | ESR1 (0.37) | — | |
| SCHEMBL5232640 | 0.82 | ESR1 (0.34) | — | |
| SCHEMBL5232723 | 0.81 | ESR1 (0.33) | — | |
| SCHEMBL6893879 | 0.81 | ESR1 (0.32) | — | |
| SCHEMBL5231240 | 0.80 | — | — | |
| SCHEMBL5229427 | 0.80 | ABCC2 (0.33) | — | |
| SCHEMBL5231629 | 0.80 | ESR1 (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 4 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-1336612-B1 | NOVEL CARBAPENEM DERIVATIVES | MEIJI SEIKA KAISHA (JP) | 2007-01-17 | — | — | EP | disclosed |
| US-6908913-B2 | Carbapenem derivatives | MEIJI SEIKI KAISHA, LTD. (JP) | 2005-06-21 | — | — | US | disclosed |
| US-20040038967-A1 | Novel carbapenem derivatives | MEIJI SEIKI KAISHA, LTD. (JP) | 2004-02-26 | — | — | US | disclosed |
| EP-1336612-A1 | NOVEL CARBAPENEM DERIVATIVES | MEIJI SEIKA KAISHA LTD. (JP) | 2003-08-20 | — | — | EP | disclosed |