Predicted protein targets (top 8)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ACACB | O00763 | 1/20 | 0.34 |
| ▸ | ESR2 | Q92731 | 2/20 | 0.32 |
| ▸ | P2RY14 | Q15391 | 1/20 | 0.31 |
| ▸ | CYP2C9 | P11712 | 2/20 | 0.30 |
| ▸ | ESR1 | P03372 | 1/20 | 0.30 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.30 |
| ▸ | EGLN1 | Q9GZT9 | 1/20 | 0.30 |
| ▸ | EGLN3 | Q9H6Z9 | 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 | |
|---|---|---|---|---|
| SCHEMBL8834377 | 0.84 | ACACB (0.32) | ACACB | |
| SCHEMBL7914155 | 0.81 | RECQL (0.32) | ACACB | |
| SCHEMBL17851229 | 0.81 | ESR2 (0.37) | ACACBESR2P2RY14CYP2C9ESR1 | |
| SCHEMBL7914081 | 0.80 | ALDH1A1 (0.39) | ACACBESR2CYP2C9 | |
| SCHEMBL10527663 | 0.78 | GRM5 (0.36) | ACACBESR2CYP2C9ESR1CYP3A4 | |
| SCHEMBL9472090 | 0.77 | SLC6A2 (0.34) | ACACBESR2CYP2C9ESR1CYP3A4 | |
| SCHEMBL7911260 | 0.77 | CYP2C9 (0.37) | ACACBESR2CYP2C9 | |
| SCHEMBL27867484 | 0.75 | ESR2 (0.38) | ACACBESR2CYP2C9ESR1CYP3A4 | |
| SCHEMBL27867483 | 0.75 | ESR2 (0.38) | ACACBESR2CYP2C9ESR1CYP3A4 | |
| SCHEMBL8834299 | 0.74 | CYP2C9 (0.31) | ACACBESR2CYP2C9 |
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 |