⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL9727899 | 1.00 | — | — | |
| SCHEMBL9727894 | 1.00 | — | — | |
| SCHEMBL2448107 | 0.94 | HPGD (0.45) | — | |
| SCHEMBL28364585 | 0.82 | HPGD (0.49) | — | |
| SCHEMBL1698442 | 0.80 | — | — | |
| SCHEMBL1698570 | 0.80 | — | — | |
| SCHEMBL321670 | 0.80 | — | — | |
| SCHEMBL11321648 | 0.80 | — | — | |
| SCHEMBL9538144 | 0.79 | HPGD (0.44) | — | |
| Methylene Chloride SCHEMBL7294170 | 0.79 | ALDH1A1 (0.49) | — |
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-5116832-A | Penicillins substituted with heterocyclic oxygen ring | SUNTORY LIMITED (JP) | 1992-05-26 | — | — | US | disclosed |
| EP-0273747-A1 | Penem derivatives, production and use thereof | SUNTORY KABUSHIKI KAISHA, also known as SUNTORY LTD. (JP) | 1988-07-06 | — | — | EP | disclosed |