⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL9020498 | 0.89 | L3MBTL1 (0.32) | — | |
| SCHEMBL9754728 | 0.77 | MEN1 (0.31) | — | |
| SCHEMBL9596084 | 0.76 | MEN1 (0.30) | — | |
| SCHEMBL9754778 | 0.76 | MEN1 (0.30) | — | |
| SCHEMBL9754742 | 0.75 | MEN1 (0.32) | — | |
| SCHEMBL9596202 | 0.72 | GBA2 (0.32) | — | |
| SCHEMBL9754704 | 0.70 | GBA2 (0.31) | — | |
| SCHEMBL22980252 | 0.70 | GBA2 (0.36) | — | |
| SCHEMBL4078697 | 0.70 | GBA2 (0.41) | — | |
| SCHEMBL9595806 | 0.70 | GBA2 (0.36) | — |
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 |
|---|---|---|---|---|---|---|---|
| WO-1991014687-A1 | 2-(SUBSTITUTED PYRROLIDINYLTHIO)CARBAPENEM DERIVATIVES | BANYU PHARMACEUTICAL CO., LTD. (JP) | 1991-10-03 | — | — | WO | disclosed |