⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL4264856 | 1.00 | — | — | |
| SCHEMBL4273422 | 0.73 | — | — | |
| SCHEMBL4273427 | 0.73 | — | — | |
| SCHEMBL4268624 | 0.73 | FAAH (0.31) | — | |
| SCHEMBL4264878 | 0.73 | HSD11B1 (0.37) | — | |
| SCHEMBL6156357 | 0.73 | HSD11B1 (0.37) | — | |
| SCHEMBL4269809 | 0.72 | — | — | |
| SCHEMBL4269805 | 0.72 | — | — | |
| SCHEMBL17729315 | 0.71 | DPP4 (0.42) | — | |
| SCHEMBL12980330 | 0.70 | CA12 (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 5 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-7485632-B2 | Cephalosporins | NABRIVA THERAPEUTICS FORSCHUNGS GMBH (AT) | 2009-02-03 | — | — | US | disclosed |
| EP-1529050-B1 | CEPHALOSPORINS | SANDOZ AG (CH) | 2006-05-24 | — | — | EP | disclosed |
| US-20050234233-A1 | e.g. 3-{(E)[[1-trans-(4-Amino-cyclohexylamino)-iminomethyl]-methylhydrazono]methyl}-7- {[(5-amino-1,2,4-thiadiazol-3-yl)-(Z)-(fluoromethoxyimino)-acetyl]amino}-3-cephem-4-carboxylic acid; microbiocide; Escherichia, Enterobacter, Enterococcus, Klebsiella, Streptococcus, Staphylococcus and Pseudomonas | NABRIVA THERAPEUTICS AG (AT) | 2005-10-20 | — | — | US | disclosed |
| EP-1529050-A1 | CEPHALOSPORINS | Sandoz AG (CH) | 2005-05-11 | — | — | EP | disclosed |
| WO-2004007505-A1 | CEPHALOSPORINS | SANDOZ AG (CH) | 2004-01-22 | — | — | WO | disclosed |