⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL450405 | 0.60 | — | — | |
| SCHEMBL8606978 | 0.59 | — | — | |
| SCHEMBL11098740 | 0.56 | — | — | |
| SCHEMBL2504140 | 0.52 | — | — | |
| SCHEMBL8047062 | 0.51 | — | — | |
| SCHEMBL11720970 | 0.51 | CRBN (0.50) | — | |
| SCHEMBL6202267 | 0.51 | — | — | |
| SCHEMBL11068390 | 0.49 | — | — | |
| SCHEMBL8866832 | 0.47 | OR51E2 (0.47) | — | |
| SCHEMBL5056719 | 0.47 | OR51E2 (0.39) | — |
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 |
|---|---|---|---|---|---|---|---|
| EP-0003677-B1 | PYRIMIDONES, PROCESSES FOR THEIR PREPARATION AND PHARMACEUTICAL COMPOSITIONS CONTAINING THEM | SMITH KLINE & FRENCH LABORATORIES LIMITED (GB) | 1981-11-11 | — | — | EP | claimed |