Predicted protein targets (top 14)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KDM1A | O60341 | 1/20 | 0.38 |
| ▸ | RCOR1 | Q9UKL0 | 1/20 | 0.38 |
| ▸ | SCN9A | Q15858 | 1/20 | 0.36 |
| ▸ | HDAC3 | O15379 | 1/20 | 0.34 |
| ▸ | HDAC1 | Q13547 | 1/20 | 0.34 |
| ▸ | HDAC2 | Q92769 | 1/20 | 0.34 |
| ▸ | TSHR | P16473 | 1/20 | 0.32 |
| ▸ | LIPE | Q05469 | 3/20 | 0.32 |
| ▸ | CHRM4 | P08173 | 1/20 | 0.31 |
| ▸ | HCRTR1 | O43613 | 1/20 | 0.31 |
| ▸ | HCRTR2 | O43614 | 1/20 | 0.31 |
| ▸ | SLC6A4 | P31645 | 1/20 | 0.31 |
| ▸ | SLC6A3 | Q01959 | 1/20 | 0.31 |
| ▸ | EPHX2 | P34913 | 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 | |
|---|---|---|---|---|
| SCHEMBL7782355 | 1.00 | KDM1A (0.38) | KDM1ARCOR1SCN9AHDAC3HDAC1 | |
| SCHEMBL7782396 | 0.96 | KDM1A (0.38) | KDM1ARCOR1SCN9AHDAC3HDAC1 | |
| SCHEMBL7782392 | 0.96 | KDM1A (0.38) | KDM1ARCOR1SCN9AHDAC3HDAC1 | |
| SCHEMBL7782395 | 0.94 | KDM1A (0.38) | KDM1ARCOR1SCN9AHDAC3HDAC1 | |
| SCHEMBL7782390 | 0.94 | KDM1A (0.38) | KDM1ARCOR1SCN9AHDAC3HDAC1 | |
| SCHEMBL8997285 | 0.94 | KDM1A (0.41) | KDM1ARCOR1SCN9AHDAC3HDAC1 | |
| SCHEMBL9062380 | 0.93 | KDM1A (0.40) | KDM1ARCOR1SCN9AHDAC3HDAC1 | |
| SCHEMBL9060432 | 0.93 | KDM1A (0.40) | KDM1ARCOR1SCN9AHDAC3HDAC1 | |
| SCHEMBL9060878 | 0.93 | KDM1A (0.40) | KDM1ARCOR1SCN9AHDAC3HDAC1 | |
| SCHEMBL9061756 | 0.93 | KDM1A (0.40) | KDM1ARCOR1SCN9AHDAC3HDAC1 |
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 |