Predicted protein targets (top 6)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | DAO | P14920 | 1/20 | 0.33 |
| ▸ | SPHK2 | Q9NRA0 | 4/20 | 0.32 |
| ▸ | SPHK1 | Q9NYA1 | 3/20 | 0.32 |
| ▸ | ENPP2 | Q13822 | 2/20 | 0.31 |
| ▸ | PPARA | Q07869 | 4/20 | 0.30 |
| ▸ | PPARG | P37231 | 1/20 | 0.30 |
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 | |
|---|---|---|---|---|
| SCHEMBL7781381 | 1.00 | DAO (0.33) | DAOSPHK2SPHK1ENPP2PPARA | |
| SCHEMBL7781616 | 0.97 | ENPP2 (0.34) | DAOSPHK2SPHK1ENPP2PPARA | |
| SCHEMBL7781618 | 0.97 | ENPP2 (0.34) | DAOSPHK2SPHK1ENPP2PPARA | |
| SCHEMBL7781439 | 0.93 | DAO (0.34) | DAO | |
| SCHEMBL7781446 | 0.93 | DAO (0.34) | DAO | |
| SCHEMBL7778884 | 0.85 | DRD2 (0.38) | DAOSPHK2SPHK1PPARG | |
| SCHEMBL7778881 | 0.85 | DRD2 (0.38) | DAOSPHK2SPHK1PPARG | |
| SCHEMBL7774391 | 0.85 | PDE4D (0.32) | — | |
| SCHEMBL7774386 | 0.85 | PDE4D (0.32) | — | |
| SCHEMBL7779318 | 0.84 | SPHK2 (0.35) | SPHK2SPHK1ENPP2 |
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 3 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-0732330-B1 | Di-1,3-dioxane derivatives useful as liquid crystals | ROLIC AG (CH) | 2001-09-12 | — | — | EP | disclosed |
| US-5667721-A | Liquid crystalline di-1,3-dioxane derivatives | ROLIC AG (CH) | 1997-09-16 | — | — | US | disclosed |
| EP-0732330-A1 | Di-1,3-dioxane derivatives useful as liquid crystals | F. HOFFMANN-LA ROCHE AG (CH) | 1996-09-18 | — | — | EP | disclosed |