Predicted protein targets (top 19)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | SLC6A3 | Q01959 | 15/20 | 0.52 |
| ▸ | SLC6A4 | P31645 | 14/20 | 0.52 |
| ▸ | SLC6A2 | P23975 | 10/20 | 0.52 |
| ▸ | DDB1 | Q16531 | 1/20 | 0.37 |
| ▸ | CRBN | Q96SW2 | 1/20 | 0.37 |
| ▸ | PDE4A | P27815 | 1/20 | 0.33 |
| ▸ | PDE4B | Q07343 | 1/20 | 0.33 |
| ▸ | PDE4C | Q08493 | 1/20 | 0.33 |
| ▸ | PDE4D | Q08499 | 1/20 | 0.33 |
| ▸ | CYP3A4 | P08684 | 4/20 | 0.33 |
| ▸ | CYP2D6 | P10635 | 4/20 | 0.33 |
| ▸ | KCNH2 | Q12809 | 4/20 | 0.33 |
| ▸ | CYP1A1 | P04798 | 3/20 | 0.33 |
| ▸ | CYP1A2 | P05177 | 3/20 | 0.33 |
| ▸ | ABCC9 | O60706 | 1/20 | 0.32 |
| ▸ | ABCC8 | Q09428 | 1/20 | 0.32 |
| ▸ | KCNJ11 | Q14654 | 1/20 | 0.32 |
| ▸ | KCNJ8 | Q15842 | 1/20 | 0.32 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.32 |
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 | |
|---|---|---|---|---|
| SCHEMBL6664575 | 0.88 | SLC6A4 (0.52) | SLC6A3SLC6A4SLC6A2DDB1CRBN | |
| SCHEMBL28624808 | 0.86 | SLC6A4 (0.67) | SLC6A3SLC6A4SLC6A2CYP3A4CYP2D6 | |
| Ethylene SCHEMBL28629416 | 0.83 | SLC6A4 (0.63) | SLC6A3SLC6A4SLC6A2CYP3A4CYP2D6 | |
| SCHEMBL7760357 | 0.77 | SLC6A3 (0.53) | SLC6A3SLC6A4SLC6A2CYP2D6KCNH2 | |
| SCHEMBL6689140 | 0.77 | SLC6A3 (0.50) | SLC6A3SLC6A4SLC6A2CYP3A4CYP2D6 | |
| SCHEMBL29097452 | 0.76 | SLC6A4 (0.55) | SLC6A3SLC6A4SLC6A2CYP3A4CYP2D6 | |
| SCHEMBL6524970 | 0.75 | SLC6A4 (0.51) | SLC6A3SLC6A4SLC6A2CYP2D6KCNH2 | |
| SCHEMBL8921684 | 0.74 | SLC6A3 (0.50) | SLC6A3SLC6A4SLC6A2CYP2D6KCNH2 | |
| SCHEMBL9180327 | 0.73 | SLC6A3 (0.49) | SLC6A3SLC6A4SLC6A2CYP3A4CYP2D6 | |
| SCHEMBL8536568 | 0.72 | SLC6A4 (0.48) | SLC6A3SLC6A4SLC6A2CYP3A4CYP2D6 |
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-1012148-B1 | MONOACETALS OF BICYCLOHEXYL-4,4-DIONE AND THEIR USE IN PREPARING LIQUID CRYSTALS | ROLIC AG (CH) | 2004-09-15 | — | — | EP | disclosed |
| EP-1012148-A1 | MONOACETALS OF BICYCLOHEXYL-4,4-DIONE AND THEIR USE IN PREPARING LIQUID CRYSTALS | Rolic AG (CH) | 2000-06-28 | — | — | EP | disclosed |
| WO-1999012920-A1 | MONOACETALS OF BICYCLOHEXYL-4,4-DIONE AND THEIR USE IN PREPARING LIQUID CRYSTALS | ROLIC AG (CH) | 1999-03-18 | — | — | WO | disclosed |