Predicted protein targets (top 5)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.37 |
| ▸ | TSHR | P16473 | 1/20 | 0.37 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.37 |
| ▸ | MAOB | P27338 | 5/20 | 0.34 |
| ▸ | MAOA | P21397 | 1/20 | 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 | |
|---|---|---|---|---|
| SCHEMBL7913746 | 1.00 | ALDH1A1 (0.37) | ALDH1A1TSHRHSD17B10MAOBMAOA | |
| SCHEMBL7911222 | 0.97 | ALDH1A1 (0.39) | ALDH1A1TSHRHSD17B10MAOBMAOA | |
| SCHEMBL7911219 | 0.97 | ALDH1A1 (0.39) | ALDH1A1TSHRHSD17B10MAOBMAOA | |
| SCHEMBL7903582 | 0.92 | ALDH1A1 (0.36) | ALDH1A1TSHRHSD17B10MAOBMAOA | |
| SCHEMBL7903580 | 0.92 | ALDH1A1 (0.36) | ALDH1A1TSHRHSD17B10MAOBMAOA | |
| SCHEMBL7913984 | 0.90 | ALDH1A1 (0.35) | ALDH1A1TSHRHSD17B10MAOBMAOA | |
| SCHEMBL7913980 | 0.90 | ALDH1A1 (0.35) | ALDH1A1TSHRHSD17B10MAOBMAOA | |
| SCHEMBL7911184 | 0.89 | ALDH1A1 (0.34) | ALDH1A1TSHRHSD17B10MAOB | |
| SCHEMBL7911182 | 0.89 | ALDH1A1 (0.34) | ALDH1A1TSHRHSD17B10MAOB | |
| SCHEMBL7911192 | 0.89 | ALDH1A1 (0.36) | ALDH1A1TSHRHSD17B10MAOBMAOA |
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 |