⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL11315263 | 0.88 | CYP1A2 (0.59) | — | |
| SCHEMBL6275094 | 0.75 | TSHR (0.57) | — | |
| SCHEMBL6698873 | 0.72 | CYP1A2 (0.59) | — | |
| SCHEMBL12763781 | 0.69 | CYP1A2 (0.61) | — | |
| SCHEMBL14546926 | 0.67 | — | — | |
| SCHEMBL19736602 | 0.66 | CYP1A2 (0.55) | — | |
| SCHEMBL10864267 | 0.66 | LMNA (0.34) | — | |
| SCHEMBL10089552 | 0.66 | — | — | |
| SCHEMBL15286383 | 0.64 | RAB9A (0.53) | — | |
| Hydrochloric Acid SCHEMBL15286474 | 0.63 | RAB9A (0.51) | — |
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 |
|---|---|---|---|---|---|---|---|
| EP-0232623-B1 | 1-CARBACEPHALOSPORIN ANTIBIOTICS | ELI LILLY AND COMPANY (US) | 1993-03-17 | — | — | EP | disclosed |
| US-4892942-A | 1-CARBA (DETHIA)CEPHALOSPORINS | ELI LILLY AND COMPANY (US) | 1990-01-09 | — | — | US | disclosed |
| US-4791106-A | 1-Carbacephalosporin antibiotics | ELI LILLY AND COMPANY (US) | 1988-12-13 | — | — | US | disclosed |
| EP-0232623-A1 | 1-Carbacephalosporin antibiotics | ELI LILLY AND COMPANY (US) | 1987-08-19 | — | — | EP | disclosed |
| EP-0192060-A1 | Heterocyclic compounds | NIHON BAYER AGROCHEM K.K. (JP) | 1986-08-27 | — | — | EP | disclosed |