⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL7103639 | 0.90 | — | — | |
| SCHEMBL9359108 | 0.85 | — | — | |
| SCHEMBL9136927 | 0.83 | — | — | |
| SCHEMBL7108589 | 0.82 | — | — | |
| SCHEMBL9139774 | 0.81 | LPAR1 (0.40) | — | |
| SCHEMBL9136104 | 0.80 | CA12 (0.39) | — | |
| SCHEMBL9137812 | 0.80 | — | — | |
| SCHEMBL9136110 | 0.78 | — | — | |
| SCHEMBL9138348 | 0.77 | LPAR1 (0.41) | — | |
| SCHEMBL5973624 | 0.76 | — | — |
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 |
|---|---|---|---|---|---|---|---|
| US-5384328-A | Anticholesterol agents | WARNER-LAMBERT COMPANY (US) | 1995-01-24 | — | — | US | disclosed |