⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL30585939 | 0.81 | HPGD (0.33) | — | |
| SCHEMBL19198473 | 0.77 | — | — | |
| SCHEMBL7446531 | 0.74 | — | — | |
| SCHEMBL13272906 | 0.73 | POLB (0.39) | — | |
| SCHEMBL10866983 | 0.73 | — | — | |
| SCHEMBL10415663 | 0.68 | CASP1 (0.38) | — | |
| SCHEMBL10994197 | 0.67 | — | — | |
| SCHEMBL1027741 | 0.65 | — | — | |
| SCHEMBL2239369 | 0.64 | — | — | |
| SCHEMBL10431026 | 0.64 | — | — |
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 4 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-0460881-B1 | Process for bicyclic beta-lactams | UNIV NOTRE DAME DU LAC (US) | 1995-11-22 | — | — | EP | disclosed |
| US-5106968-A | Antibiotics | UNIVERSITY OF NOTRE DAME DU LAC COLLEGE OF SCIENCE (US) | 1992-04-21 | — | — | US | disclosed |
| EP-0460881-A1 | Process for bicyclic beta-lactams | THE UNIVERSITY OF NOTRE DAME DU LAC (US) | 1991-12-11 | — | — | EP | disclosed |
| US-5051502-A | Process for forming antibiotics | UNIVERSITY OF NOTRE DAME DU LAC (US) | 1991-09-24 | — | — | US | disclosed |