Predicted protein targets (top 8)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PPARD | Q03181 | 13/20 | 0.40 |
| ▸ | PPARA | Q07869 | 9/20 | 0.40 |
| ▸ | PPARG | P37231 | 3/20 | 0.37 |
| ▸ | ESR1 | P03372 | 3/20 | 0.36 |
| ▸ | ESR2 | Q92731 | 1/20 | 0.36 |
| ▸ | ENPP3 | O14638 | 1/20 | 0.35 |
| ▸ | ENPP1 | P22413 | 1/20 | 0.35 |
| ▸ | FFAR1 | O14842 | 1/20 | 0.33 |
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 | |
|---|---|---|---|---|
| SCHEMBL5039979 | 0.89 | PPARD (0.41) | PPARDPPARAPPARGESR1ESR2 | |
| SCHEMBL5040082 | 0.88 | PPARD (0.38) | PPARDPPARAPPARGESR1ESR2 | |
| SCHEMBL5038699 | 0.86 | PPARD (0.37) | PPARDPPARAPPARGESR1ESR2 | |
| SCHEMBL5035534 | 0.86 | PPARD (0.39) | PPARDPPARAESR1ESR2ENPP3 | |
| SCHEMBL5040469 | 0.85 | PPARD (0.37) | PPARDPPARAESR1ESR2ENPP3 | |
| SCHEMBL5038136 | 0.84 | ENPP3 (0.38) | PPARDPPARAPPARGESR1ESR2 | |
| SCHEMBL5040466 | 0.82 | ESR1 (0.39) | PPARDPPARAPPARGESR1ESR2 | |
| SCHEMBL5039085 | 0.81 | TP53 (0.45) | PPARDPPARAESR1ESR2 | |
| SCHEMBL5046003 | 0.80 | ESR1 (0.51) | ESR1ESR2ENPP3ENPP1 | |
| SCHEMBL6470291 | 0.80 | PPARD (0.36) | PPARDPPARAPPARGESR1ESR2 |
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-1334094-B1 | CHOLESTEROL LOWERING BENZO[B]THIOPHENES AND BENZO[D]ISOTHIAZOLES | HOFFMANN LA ROCHE (CH) | 2004-12-29 | — | — | EP | disclosed |