Predicted protein targets (top 13)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TSHR | P16473 | 1/20 | 0.35 |
| ▸ | PDE2A | O00408 | 1/20 | 0.35 |
| ▸ | EPHX2 | P34913 | 1/20 | 0.34 |
| ▸ | NR1H4 | Q96RI1 | 1/20 | 0.34 |
| ▸ | HCRTR1 | O43613 | 7/20 | 0.34 |
| ▸ | HCRTR2 | O43614 | 7/20 | 0.34 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.33 |
| ▸ | GRM2 | Q14416 | 1/20 | 0.32 |
| ▸ | GRIN2B | Q13224 | 1/20 | 0.32 |
| ▸ | PPARD | Q03181 | 1/20 | 0.32 |
| ▸ | PPARA | Q07869 | 1/20 | 0.32 |
| ▸ | SERPINE1 | P05121 | 1/20 | 0.32 |
| ▸ | CHRM5 | P08912 | 2/20 | 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 | |
|---|---|---|---|---|
| SCHEMBL7729773 | 0.97 | TSHR (0.40) | TSHRPDE2AEPHX2NR1H4HCRTR1 | |
| SCHEMBL14382043 | 0.89 | CYP1A2 (0.38) | TSHRPDE2AEPHX2NR1H4HCRTR1 | |
| SCHEMBL7734998 | 0.89 | TAAR1 (0.33) | TSHRPDE2AEPHX2NR1H4HCRTR1 | |
| SCHEMBL7722612 | 0.88 | PRMT6 (0.38) | TSHREPHX2NR1H4ALDH1A1GRM2 | |
| SCHEMBL7734959 | 0.88 | DAO (0.40) | TSHREPHX2NR1H4HCRTR1HCRTR2 | |
| SCHEMBL7729295 | 0.87 | TSHR (0.35) | TSHRPDE2AEPHX2NR1H4HCRTR1 | |
| SCHEMBL7732166 | 0.87 | PPARD (0.35) | TSHRPDE2AEPHX2NR1H4HCRTR1 | |
| SCHEMBL7735331 | 0.86 | KIF11 (0.33) | TSHRPDE2AEPHX2NR1H4 | |
| SCHEMBL7731615 | 0.86 | TSHR (0.35) | TSHRPDE2AEPHX2NR1H4HCRTR1 | |
| SCHEMBL7731930 | 0.86 | S1PR1 (0.34) | ALDH1A1 |
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-0786445-B1 | DIFLUOROXYMETHANE DERIVATIVE AND LIQUID CRYSTAL COMPOSITION | CHISSO CORP (JP) | 2002-07-17 | — | — | EP | disclosed |
| US-5858270-A | Difluorooxymethane derivative and liquid crystal composition | CHISSO CORPORATION (JP) | 1999-01-12 | — | — | US | disclosed |
| EP-0786445-A1 | DIFLUOROXYMETHANE DERIVATIVE AND LIQUID CRYSTAL COMPOSITION | CHISSO CORPORATION (JP) | 1997-07-30 | — | — | EP | disclosed |