⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL7080852 | 0.72 | — | — | |
| SCHEMBL10715341 | 0.67 | — | — | |
| SCHEMBL4638740 | 0.64 | — | — | |
| SCHEMBL206562 | 0.62 | — | — | |
| SCHEMBL206561 | 0.62 | — | — | |
| SCHEMBL29838521 | 0.62 | — | — | |
| SCHEMBL28364680 | 0.62 | — | — | |
| SCHEMBL22594498 | 0.62 | — | — | |
| SCHEMBL22221136 | 0.62 | — | — | |
| SCHEMBL5079676 | 0.60 | — | — |
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 1 patent. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-5302711-A | Ester cleavage process for use with β-lactams | ELI LILLY AND COMPANY (US) | 1994-04-12 | — | — | US | disclosed |