⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL15402881 | 0.80 | — | — | |
| SCHEMBL15403821 | 0.78 | — | — | |
| SCHEMBL15402866 | 0.76 | — | — | |
| SCHEMBL15403551 | 0.74 | — | — | |
| SCHEMBL726478 | 0.73 | — | — | |
| SCHEMBL15403207 | 0.72 | — | — | |
| SCHEMBL15403180 | 0.72 | — | — | |
| SCHEMBL19343737 | 0.72 | — | — | |
| SCHEMBL24709 | 0.72 | — | — | |
| SCHEMBL23464978 | 0.71 | ALDH1A1 (0.33) | — |
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-1551403-B1 | 5-SUBSTITUTED 2H-PYRAZONE-3-CARBOXYLIC ACID DERIVATIVES AS ANTILIPOLYTIC AGENTS FOR THE TREATMENT OF METABOLIC-RELATED DISORDERS SUCH AS DYSLIPIDEMIA | ARENA PHARM INC (US) | 2009-04-29 | — | — | EP | disclosed |