⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL1387683 | 0.72 | — | — | |
| Bromide SCHEMBL4539695 | 0.70 | — | — | |
| SCHEMBL7480588 | 0.61 | — | — | |
| SCHEMBL18656543 | 0.58 | — | — | |
| Hydrochloric Acid SCHEMBL8987314 | 0.58 | — | — | |
| SCHEMBL4394267 | 0.53 | — | — | |
| SCHEMBL320324 | 0.40 | — | — | |
| SCHEMBL452580 | 0.37 | — | — | |
| SCHEMBL2774955 | 0.34 | — | — | |
| SCHEMBL8465809 | 0.34 | CASP1 (0.50) | — |
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-0373216-A1 | CEPHALOSPORIN COMPOUNDS OR THEIR SALTS, PROCESS FOR THEIR PREPARATION, AND PARMACEUTICAL COMPOSITIONS | TEIJIN LIMITED (JP) | 1990-06-20 | — | — | EP | disclosed |
| EP-0172919-A1 | CEPHALOSPORIN DERIVATIVES, PROCESS FOR THEIR PREPARATION, AND THEIR PHARMACEUTICAL USE | TEIJIN LIMITED (JP) | 1986-03-05 | — | — | EP | disclosed |
| US-4438114-A | β-Lactam antibiotics | BAYER AKTIENGESELLSCHAFT (DE) | 1984-03-20 | — | — | US | disclosed |