⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL9595490 | 1.00 | — | — | |
| SCHEMBL6978861 | 0.81 | USP2 (0.31) | — | |
| SCHEMBL6978858 | 0.81 | USP2 (0.31) | — | |
| SCHEMBL2133453 | 0.74 | CHRM2 (0.35) | — | |
| SCHEMBL449025 | 0.74 | CHRM2 (0.35) | — | |
| SCHEMBL433223 | 0.74 | CHRM2 (0.35) | — | |
| SCHEMBL26663582 | 0.69 | CHRM2 (0.35) | — | |
| SCHEMBL13167071 | 0.67 | NR1H2 (0.46) | — | |
| SCHEMBL15152157 | 0.67 | NR1H2 (0.40) | — | |
| SCHEMBL9611275 | 0.66 | HSD11B1 (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 3 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-0545290-B1 | Aminoalkylpyrrolidinylthiocarbapenem derivatives | BANYU PHARMA CO LTD (JP) | 2000-08-23 | — | — | EP | disclosed |
| US-5550121-A | ANTIBIOTICS | BANYU PHARMACEUTICAL CO., LTD. (JP) | 1996-08-27 | — | — | US | disclosed |
| EP-0545290-A1 | Aminoalkylpyrrolidinylthiocarbapenem derivatives | BANYU PHARMACEUTICAL CO., LTD. (JP) | 1993-06-09 | — | — | EP | disclosed |