⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL11512934 | 0.65 | — | — | |
| SCHEMBL17002547 | 0.64 | ALOX15 (0.38) | — | |
| SCHEMBL4671779 | 0.64 | — | — | |
| SCHEMBL6475272 | 0.61 | ALOX15 (0.36) | — | |
| SCHEMBL458869 | 0.61 | SIGMAR1 (0.40) | — | |
| SCHEMBL1680245 | 0.60 | — | — | |
| SCHEMBL363546 | 0.60 | — | — | |
| SCHEMBL8535533 | 0.58 | — | — | |
| SCHEMBL15909413 | 0.56 | GSK3A (0.45) | — | |
| SCHEMBL7808227 | 0.56 | — | — |
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 |
|---|---|---|---|---|---|---|---|
| US-4346076-A | Bis-tetrazoylmethyl substituted cephalosporin antibiotics | ELI LILLY AND COMPANY (US) | 1982-08-24 | — | — | US | disclosed |
| EP-0048169-A2 | Bis-tetrazoylmethyl substituted cephalosporin antibiotics, their preparation and pharmaceutical formulations containing them | ELI LILLY AND COMPANY (US) | 1982-03-24 | — | — | EP | disclosed |