⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL9820319 | 0.89 | — | — | |
| SCHEMBL9820359 | 0.81 | — | — | |
| SCHEMBL9820355 | 0.77 | — | — | |
| SCHEMBL9820352 | 0.65 | — | — | |
| SCHEMBL9820331 | 0.60 | — | — | |
| SCHEMBL31314 | 0.58 | — | — | |
| SCHEMBL3937097 | 0.56 | MMP2 (0.33) | — | |
| SCHEMBL3937098 | 0.56 | MMP2 (0.33) | — | |
| SCHEMBL9820374 | 0.55 | NPSR1 (0.33) | — | |
| SCHEMBL9820354 | 0.55 | NPSR1 (0.33) | — |
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 |
|---|---|---|---|---|---|---|---|
| EP-0260042-B1 | 2-(1-OXO-1-IMINO-1-THIACYCLOALKYL)-THIOPENEM DERIVATIVES | PFIZER INC. (US) | 1991-12-27 | — | — | EP | disclosed |
| EP-0260042-A1 | 2-(1-Oxo-1-imino-1-thiacycloalkyl)-Thiopenem derivatives | PFIZER INC. (US) | 1988-03-16 | — | — | EP | disclosed |