Predicted protein targets (top 6)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TSHR | P16473 | 2/20 | 0.40 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.40 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.40 |
| ▸ | MAOB | P27338 | 3/20 | 0.34 |
| ▸ | KCNH2 | Q12809 | 2/20 | 0.32 |
| ▸ | 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 | |
|---|---|---|---|---|
| SCHEMBL7911089 | 0.96 | TSHR (0.43) | TSHRALDH1A1HSD17B10MAOBKCNH2 | |
| SCHEMBL9336876 | 0.91 | MAOB (0.36) | TSHRMAOBKCNH2MAOA | |
| SCHEMBL9336895 | 0.91 | MAOB (0.36) | TSHRMAOBKCNH2MAOA | |
| SCHEMBL7903777 | 0.91 | ALDH1A1 (0.39) | TSHRALDH1A1HSD17B10MAOBMAOA | |
| SCHEMBL7911229 | 0.90 | ALDH1A1 (0.38) | TSHRALDH1A1HSD17B10MAOBMAOA | |
| SCHEMBL7903600 | 0.89 | ALDH1A1 (0.43) | TSHRALDH1A1HSD17B10MAOBMAOA | |
| SCHEMBL8834390 | 0.88 | ALDH1A1 (0.39) | TSHRALDH1A1HSD17B10MAOB | |
| SCHEMBL9337081 | 0.87 | MAOB (0.39) | TSHRMAOBKCNH2MAOA | |
| SCHEMBL9337064 | 0.87 | MAOB (0.39) | TSHRMAOBKCNH2MAOA | |
| SCHEMBL7911214 | 0.87 | ALDH1A1 (0.36) | TSHRALDH1A1HSD17B10MAOBMAOA |
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 |