Predicted protein targets (top 7)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP2D6 | P10635 | 1/20 | 0.32 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.32 |
| ▸ | PPARG | P37231 | 2/20 | 0.32 |
| ▸ | PPARD | Q03181 | 2/20 | 0.32 |
| ▸ | PPARA | Q07869 | 2/20 | 0.32 |
| ▸ | TRPA1 | O75762 | 1/20 | 0.31 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.31 |
Click a target to see other patent compounds predicted against it — the reverse direction, in place.
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 | |
|---|---|---|---|---|
| SCHEMBL11281563 | 0.88 | PPARG (0.32) | CYP2D6CYP2C19PPARGPPARDPPARA | |
| SCHEMBL11266377 | 0.77 | PPARG (0.31) | PPARGPPARA | |
| SCHEMBL11268924 | 0.77 | TSHR (0.33) | — | |
| SCHEMBL11277703 | 0.74 | PPARG (0.31) | PPARGPPARDPPARA | |
| SCHEMBL11267293 | 0.73 | CYP2D6 (0.36) | CYP2D6CYP2C19PPARGPPARDPPARA | |
| SCHEMBL29265365 | 0.70 | ALDH1A1 (0.48) | TRPA1ALDH1A1 | |
| SCHEMBL11272371 | 0.68 | ALOX15 (0.33) | ALDH1A1 | |
| SCHEMBL11268420 | 0.68 | PPARG (0.31) | PPARGPPARDPPARA | |
| SCHEMBL11268417 | 0.68 | PPARG (0.32) | PPARGPPARDPPARA | |
| SCHEMBL22828529 | 0.67 | CYP1A2 (0.53) | CYP2D6CYP2C19PPARGPPARDPPARA |
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-0054909-A2 | 9-Halo-8-hydroxy-4-methyl-4-nonenoic acids, derivatives thereof and a process for their preparation | MITSUBISHI KASEI CORPORATION (JP) | 1982-06-30 | — | — | EP | disclosed |