⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL3601529 | 0.76 | NPC1 (0.30) | — | |
| SCHEMBL3601526 | 0.75 | NPC1 (0.30) | — | |
| SCHEMBL3588516 | 0.72 | NPC1 (0.34) | — | |
| SCHEMBL10759540 | 0.72 | — | — | |
| SCHEMBL8807974 | 0.72 | — | — | |
| SCHEMBL4257301 | 0.70 | ALDH1A1 (0.31) | — | |
| SCHEMBL3592569 | 0.70 | MAPT (0.33) | — | |
| SCHEMBL4665366 | 0.69 | — | — | |
| SCHEMBL4966477 | 0.68 | — | — | |
| SCHEMBL7177847 | 0.68 | — | — |
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-7691842-B2 | Tricyclic 6-alkylidene-penems as β-lactamase inhibitors | WYETH LLC (US) | 2010-04-06 | — | — | US | disclosed |
| US-20080318921-A1 | Tricyclic 6-Alkylidene-Penems as Beta-Lactamase Inhibitors | WYETH (US) | 2008-12-25 | — | — | US | disclosed |