⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL11212045 | 0.79 | — | — | |
| SCHEMBL11032630 | 0.79 | — | — | |
| SCHEMBL10685896 | 0.77 | — | — | |
| SCHEMBL10680131 | 0.77 | — | — | |
| SCHEMBL10709560 | 0.77 | ITGB1 (0.39) | — | |
| SCHEMBL9836299 | 0.77 | ITGB1 (0.59) | — | |
| SCHEMBL10968083 | 0.77 | ITGB1 (0.59) | — | |
| SCHEMBL9836292 | 0.77 | ITGB1 (0.59) | — | |
| SCHEMBL11307625 | 0.74 | ITGB1 (0.55) | — | |
| SCHEMBL11100927 | 0.74 | ITGB1 (0.55) | — |
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 |
|---|---|---|---|---|---|---|---|
| US-4431587-A | AMINO ACID DERIVATIVE ANTIVBIOTICS | BEECHAM GROUP LIMITED (GB) | 1984-02-14 | — | — | US | disclosed |
| US-4405637-A | CARBAPENICILLIN | BEECHAM GROUP LIMITED (GB) | 1983-09-20 | — | — | US | disclosed |
| US-4401595-A | 4-Allyl azetidinone intermediate for β-lactam antibacterial agents | BEECHAM GROUP LIMITED (GB) | 1983-08-30 | — | — | US | disclosed |
| US-4350703-A | β-Lactam antibacterial agents | BEECHAM GROUP LIMITED (GB) | 1982-09-21 | — | — | US | disclosed |