Predicted protein targets (top 3)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | BACE1 | P56817 | 1/20 | 0.31 |
| ▸ | PPARG | P37231 | 1/20 | 0.31 |
| ▸ | PPARA | Q07869 | 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 | |
|---|---|---|---|---|
| SCHEMBL7730290 | 0.97 | CETP (0.30) | — | |
| SCHEMBL7731382 | 0.93 | — | — | |
| SCHEMBL7730513 | 0.92 | PTGS2 (0.33) | BACE1PPARGPPARA | |
| SCHEMBL7722822 | 0.91 | HTR2A (0.35) | BACE1PPARGPPARA | |
| SCHEMBL7730115 | 0.90 | THRB (0.36) | BACE1PPARGPPARA | |
| SCHEMBL7734852 | 0.90 | HTR2A (0.34) | BACE1PPARGPPARA | |
| SCHEMBL7730452 | 0.89 | HTR2A (0.36) | PPARGPPARA | |
| SCHEMBL7722483 | 0.89 | — | — | |
| SCHEMBL7722884 | 0.88 | RARB (0.37) | BACE1PPARGPPARA | |
| SCHEMBL7722918 | 0.88 | HDAC3 (0.33) | PPARGPPARA |
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-0786445-B1 | DIFLUOROXYMETHANE DERIVATIVE AND LIQUID CRYSTAL COMPOSITION | CHISSO CORP (JP) | 2002-07-17 | — | — | EP | disclosed |