⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL9450951 | 0.91 | NLRP3 (0.57) | — | |
| SCHEMBL9490627 | 0.89 | NLRP3 (0.53) | — | |
| SCHEMBL9488996 | 0.88 | LPAR1 (0.60) | — | |
| SCHEMBL9488235 | 0.84 | LPAR1 (0.60) | — | |
| SCHEMBL13765697 | 0.82 | — | — | |
| SCHEMBL7566736 | 0.82 | SOAT2 (0.60) | — | |
| SCHEMBL9450955 | 0.81 | NLRP3 (0.49) | — | |
| SCHEMBL9708149 | 0.81 | — | — | |
| SCHEMBL7566889 | 0.80 | NLRP3 (0.65) | — | |
| SCHEMBL9450965 | 0.79 | NLRP3 (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 3 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-5364882-A | Acyloenzyme a: cholesterol acyltransferase inhibitors, anticholesterol | WARNER-LAMBERT COMPANY (US) | 1994-11-15 | — | — | US | disclosed |
| US-5198466-A | Acylcoenzyme A Inhibitors | WARNER-LAMBERT COMPANY (US) | 1993-03-30 | — | — | US | disclosed |
| WO-1992008692-A1 | OXYSULFONYL UREA ACAT INHIBITORS | WARNER-LAMBERT COMPANY (US) | 1992-05-29 | — | — | WO | disclosed |