Predicted protein targets (top 15)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.39 |
| ▸ | TSHR | P16473 | 1/20 | 0.39 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.39 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.31 |
| ▸ | MEN1 | O00255 | 2/20 | 0.31 |
| ▸ | HPGD | P15428 | 2/20 | 0.31 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.31 |
| ▸ | CHEK1 | O14757 | 1/20 | 0.31 |
| ▸ | MAPT | P10636 | 1/20 | 0.31 |
| ▸ | MMP12 | P39900 | 1/20 | 0.31 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.31 |
| ▸ | TRPV1 | Q8NER1 | 1/20 | 0.31 |
| ▸ | EPHX2 | P34913 | 1/20 | 0.31 |
| ▸ | SCN9A | Q15858 | 1/20 | 0.30 |
| ▸ | ESR2 | Q92731 | 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 | |
|---|---|---|---|---|
| SCHEMBL7911787 | 0.88 | ALDH1A1 (0.36) | ALDH1A1TSHRHSD17B10KDM4EMEN1 | |
| SCHEMBL7903615 | 0.87 | ALDH1A1 (0.36) | ALDH1A1TSHRHSD17B10KDM4EMEN1 | |
| SCHEMBL7912222 | 0.86 | FASN (0.39) | ALDH1A1TSHRHSD17B10CHEK1MMP12 | |
| SCHEMBL10014201 | 0.85 | MMP12 (0.40) | CHEK1MMP12NPSR1TRPV1EPHX2 | |
| SCHEMBL7911165 | 0.85 | ALDH1A1 (0.43) | ALDH1A1TSHRHSD17B10KDM4EMEN1 | |
| SCHEMBL7917385 | 0.85 | ALDH1A1 (0.34) | ALDH1A1TSHRHSD17B10KDM4EMEN1 | |
| SCHEMBL7903930 | 0.84 | RECQL (0.33) | — | |
| SCHEMBL7911870 | 0.84 | ALDH1A1 (0.34) | ALDH1A1TSHRHSD17B10KDM4EMEN1 | |
| SCHEMBL7913725 | 0.84 | ALDH1A1 (0.47) | ALDH1A1TSHRHSD17B10EPHX2ESR2 | |
| SCHEMBL7911964 | 0.84 | FASN (0.38) | ALDH1A1TSHRHSD17B10CHEK1SCN9A |
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-0640578-B2 | Novel liquid crystalline compound having a 1,1,2,3,3,3,-hexafluoropropyl group and liquid crystal composition | CHISSO CORP (JP) | 2001-06-27 | — | — | EP | disclosed |
| EP-0640578-B1 | Novel liquid crystalline compound having a 1,1,2,3,3,3,-hexafluoropropyl group and liquid crystal composition | CHISSO CORP (JP) | 1997-11-05 | — | — | EP | disclosed |
| EP-0640578-A1 | Novel liquid crystalline compound having a 1,1,2,3,3,3,-hexafluoropropyl group and liquid crystal composition | Chisso Corporation (JP) | 1995-03-01 | — | — | EP | disclosed |