⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL2414212 | 0.90 | THRA (0.32) | — | |
| SCHEMBL2413551 | 0.84 | TUBB4A (0.33) | — | |
| SCHEMBL2414109 | 0.83 | STING1 (0.36) | — | |
| SCHEMBL2415950 | 0.82 | PPARA (0.33) | — | |
| SCHEMBL2410793 | 0.72 | PPARA (0.32) | — | |
| SCHEMBL2410789 | 0.72 | PPARA (0.32) | — | |
| SCHEMBL2416271 | 0.70 | MAPK14 (0.36) | — | |
| SCHEMBL2411454 | 0.67 | PPARA (0.36) | — | |
| SCHEMBL2413347 | 0.64 | PPARG (0.38) | — | |
| SCHEMBL12274123 | 0.61 | PPARA (0.35) | — |
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-8026370-B2 | Peroxisome proliferator antagonist; hyperlipemia agents; arteriosclerosis; antiischemic agents | MITSUBISHI TANABE PHARMA CORPORATION (JP) | 2011-09-27 | — | — | US | claimed |