Predicted protein targets (top 5)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KDM1A | O60341 | 2/20 | 0.32 |
| ▸ | PDE2A | O00408 | 1/20 | 0.32 |
| ▸ | EPHX2 | P34913 | 5/20 | 0.32 |
| ▸ | GRM2 | Q14416 | 1/20 | 0.31 |
| ▸ | P2RX7 | Q99572 | 2/20 | 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 | |
|---|---|---|---|---|
| SCHEMBL7774399 | 1.00 | KDM1A (0.32) | KDM1APDE2AEPHX2GRM2P2RX7 | |
| SCHEMBL7778799 | 0.94 | KDM1A (0.31) | KDM1APDE2AEPHX2GRM2 | |
| SCHEMBL7778802 | 0.94 | KDM1A (0.31) | KDM1APDE2AEPHX2GRM2 | |
| SCHEMBL7778874 | 0.93 | KDM1A (0.31) | KDM1APDE2AEPHX2 | |
| SCHEMBL7778877 | 0.93 | KDM1A (0.31) | KDM1APDE2AEPHX2 | |
| SCHEMBL7782301 | 0.88 | PDE2A (0.34) | KDM1APDE2AEPHX2GRM2P2RX7 | |
| SCHEMBL7782296 | 0.88 | PDE2A (0.34) | KDM1APDE2AEPHX2GRM2P2RX7 | |
| SCHEMBL7851837 | 0.86 | CYP2C9 (0.34) | KDM1APDE2AEPHX2GRM2P2RX7 | |
| SCHEMBL7781385 | 0.85 | KDM1A (0.32) | KDM1A | |
| SCHEMBL7781388 | 0.85 | KDM1A (0.32) | KDM1A |
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 |