Predicted protein targets (top 4)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.33 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.33 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.33 |
| ▸ | HTT | P42858 | 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 | |
|---|---|---|---|---|
| SCHEMBL21476640 | 1.00 | ALDH1A1 (0.33) | ALDH1A1MAPK1TDP1HTT | |
| SCHEMBL11329643 | 1.00 | ALDH1A1 (0.33) | ALDH1A1MAPK1TDP1HTT | |
| SCHEMBL2915127 | 0.93 | — | — | |
| SCHEMBL11904134 | 0.93 | — | — | |
| SCHEMBL12806026 | 0.93 | — | — | |
| SCHEMBL14922899 | 0.85 | — | — | |
| SCHEMBL6083462 | 0.85 | — | — | |
| SCHEMBL1300087 | 0.80 | CYP2C9 (0.36) | ALDH1A1MAPK1 | |
| SCHEMBL8488915 | 0.80 | CYP2C9 (0.36) | ALDH1A1MAPK1 | |
| SCHEMBL11434843 | 0.79 | — | — |
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 17 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-20220340893-A1 | BI-FUNCTIONAL COMPLEXES AND METHODS FOR MAKING AND USING SUCH COMPLEXES | NUEVOLUTION A/S (DK) | 2022-10-27 | — | — | US | disclosed |
| CN-103254902-B | Fluorine-containing liquid crystal compound containing ethane bridged bond and -CF2O- bridged bond | XIAN MODERN CHEMISTRY RES INST | 2015-02-11 | — | — | CN | disclosed |
| CN-103242133-B | Synthesis method of 4-[2-(trans-4-alkylcyclohexyl)ethyl] bromobenzene | XIAN MODERN CHEMISTRY RES INST | 2015-02-11 | — | — | CN | disclosed |
| CN-103145525-B | Synthesis method of 1 - fluoro - 3 - [2 - (trans- 4 - alkyl cyclohexyl) ethyl] benzene | XIAN MODERN CHEMISTRY RES INST | 2015-02-11 | — | — | CN | disclosed |
| CN-103242854-B | Fluorine-containing liquid crystal compound | XI'AN INST. OF MODERN CHEMISTRY (CN) | 2014-10-15 | — | — | CN | disclosed |
| CN-103146393-B | 3,4,5-trifluoro-biphenyl liquid crystal compound with ethylene | XIAN MODERN CHEMISTRY RES INST | 2014-07-16 | — | — | CN | disclosed |
| CN-103254902-A | Fluorine-containing liquid crystal compound containing ethane bridged bond and -CF2O- bridged bond | XIAN MODERN CHEMISTRY RES INST | 2013-08-21 | — | — | CN | disclosed |
| CN-103242854-A | Fluorine-containing liquid crystal compound | XIAN MODERN CHEMISTRY RES INST | 2013-08-14 | — | — | CN | disclosed |
| CN-103242133-A | Synthesis method of 4-[2-(trans-4-alkylcyclohexyl)ethyl] bromobenzene | XIAN MODERN CHEMISTRY RES INST | 2013-08-14 | — | — | CN | disclosed |
| CN-103145525-A | Synthesis method of 1 - fluoro - 3 - [2 - (trans- 4 - alkyl cyclohexyl) ethyl] benzene | XIAN MODERN CHEMISTRY RES INST | 2013-06-12 | — | — | CN | disclosed |
| CN-103146393-A | 3,4,5-trifluoro-biphenyl liquid crystal compound with ethylene | XIAN MODERN CHEMISTRY RES INST | 2013-06-12 | — | — | CN | disclosed |
| CN-103131425-A | Fluorine-containing liquid crystal compound | XIAN MODERN CHEMISTRY RES INST | 2013-06-05 | — | — | CN | disclosed |
| EP-2277858-A1 | AMIDE COMPOUND | Astellas Pharma Inc. (JP) | 2011-01-26 | — | — | EP | disclosed |
| EP-1640433-B1 | CHROMAN DERIVATIVE AND LIQUID-CRYSTAL COMPOSITION CONTAINING THE COMPOUND | DAINIPPON INK & CHEMICALS (JP) | 2010-08-25 | — | — | EP | disclosed |
| US-7226644-B2 | Chroman derivative and liquid-crystal composition containing the compound | DAINIPPON INK AND CHEMICALS, INC. (JP) | 2007-06-05 | — | — | US | disclosed |
| US-20060163536-A1 | Chroman dervative and liquid-crystal composition containing the compound | DAINIPPON INK AND CHEMICALS, INC. (JP) | 2006-07-27 | — | — | US | disclosed |
| EP-1640433-A1 | CHROMAN DERIVATIVE AND LIQUID-CRYSTAL COMPOSITION CONTAINING THE COMPOUND | Dainippon Ink and Chemicals, Incorporated (JP) | 2006-03-29 | — | — | EP | disclosed |