⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL3551707 | 0.87 | — | — | |
| SCHEMBL10759540 | 0.75 | — | — | |
| SCHEMBL8807974 | 0.75 | — | — | |
| SCHEMBL4665366 | 0.74 | — | — | |
| SCHEMBL7177847 | 0.73 | — | — | |
| SCHEMBL7638578 | 0.72 | — | — | |
| SCHEMBL4966477 | 0.71 | — | — | |
| SCHEMBL4964252 | 0.70 | — | — | |
| SCHEMBL3588516 | 0.70 | NPC1 (0.34) | — | |
| SCHEMBL4257301 | 0.68 | ALDH1A1 (0.31) | — |
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-20040132708-A1 | Process for preparing 6-alkylidene penem derivatives | WYETH | 2004-07-08 | — | — | US | disclosed |