⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL7469481 | 0.77 | — | — | |
| SCHEMBL9522908 | 0.73 | ALDH1A1 (0.32) | — | |
| SCHEMBL9354170 | 0.66 | — | — | |
| SCHEMBL9665293 | 0.63 | MMP1 (0.32) | — | |
| SCHEMBL9664387 | 0.63 | — | — | |
| SCHEMBL9820567 | 0.62 | — | — | |
| SCHEMBL9332302 | 0.62 | GSK3A (0.39) | — | |
| SCHEMBL7465443 | 0.62 | ADRA2A (0.36) | — | |
| SCHEMBL10662380 | 0.61 | — | — | |
| SCHEMBL1163739 | 0.60 | MGLL (0.43) | — |
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 6 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-0416814-A2 | Cephalosporin compounds, process for their preparation, pharmaceutical compositions and intermediates | BEECHAM GROUP PLC (GB) | 1991-03-13 | — | — | EP | claimed |
| EP-0416814-B1 | Antibacterial cephalosporin derivatives | PFIZER (US) | 2002-04-24 | — | — | EP | disclosed |
| US-5504076-A | Cephalosporin compounds | PFIZER INC. (US) | 1996-04-02 | — | — | US | disclosed |
| EP-0521887-A1 | CEPHALOSPORINS, PROCESS FOR THEIR PREPARATION AND PHARMACEUTICAL COMPOSITIONS CONTAINING THEM | Beecham Group p.l.c. (GB) | 1993-01-13 | — | — | EP | disclosed |
| WO-1991014692-A1 | CEPHALOSPORINS, PROCESS FOR THEIR PREPARATION AND PHARMACEUTICAL COMPOSITIONS CONTAINING THEM | BEECHAM GROUP PLC (GB) | 1991-10-03 | — | — | WO | disclosed |
| EP-0416814-A2 | Cephalosporin compounds, process for their preparation, pharmaceutical compositions and intermediates | BEECHAM GROUP PLC (GB) | 1991-03-13 | — | — | EP | disclosed |