⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL9848393 | 0.81 | — | — | |
| SCHEMBL9848395 | 0.81 | — | — | |
| SCHEMBL9848508 | 0.81 | — | — | |
| SCHEMBL19426861 | 0.77 | KDM4E (0.55) | — | |
| SCHEMBL9848455 | 0.76 | — | — | |
| SCHEMBL9848460 | 0.75 | — | — | |
| SCHEMBL9504011 | 0.73 | HTT (0.52) | — | |
| SCHEMBL9848435 | 0.73 | — | — | |
| SCHEMBL9848400 | 0.73 | — | — | |
| SCHEMBL9848512 | 0.72 | — | — |
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-0432442-A1 | ACAT inhibitors | WARNER-LAMBERT COMPANY (US) | 1991-06-19 | — | — | EP | claimed |