⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL2210464 | 0.67 | GAA (0.33) | — | |
| SCHEMBL298980 | 0.65 | — | — | |
| SCHEMBL11201569 | 0.62 | — | — | |
| SCHEMBL7876460 | 0.62 | — | — | |
| SCHEMBL349852 | 0.62 | — | — | |
| SCHEMBL5136319 | 0.62 | — | — | |
| SCHEMBL282505 | 0.62 | — | — | |
| SCHEMBL5012245 | 0.61 | — | — | |
| SCHEMBL3791857 | 0.61 | GAA (0.48) | — | |
| Potassium Ion SCHEMBL9828425 | 0.61 | — | — |
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-0042026-B1 | 3,4-DISUBSTITUTED AZETIDIN-2-ON COMPOUNDS AND PROCESS FOR THEIR PREPARATION | CIBA-GEIGY AG (CH) | 1986-01-08 | — | — | EP | disclosed |