Predicted protein targets (top 6)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ESR2 | Q92731 | 8/20 | 0.34 |
| ▸ | ESR1 | P03372 | 6/20 | 0.33 |
| ▸ | CYP2C9 | P11712 | 3/20 | 0.33 |
| ▸ | CYP3A4 | P08684 | 2/20 | 0.33 |
| ▸ | HDAC2 | Q92769 | 1/20 | 0.32 |
| ▸ | CYP2D6 | P10635 | 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 | |
|---|---|---|---|---|
| SCHEMBL6665279 | 1.00 | ESR2 (0.34) | ESR2ESR1CYP2C9CYP3A4HDAC2 | |
| SCHEMBL6665272 | 1.00 | ESR2 (0.34) | ESR2ESR1CYP2C9CYP3A4HDAC2 | |
| SCHEMBL6663187 | 0.95 | ESR2 (0.32) | ESR2ESR1CYP2C9CYP3A4HDAC2 | |
| SCHEMBL6663190 | 0.95 | ESR2 (0.32) | ESR2ESR1CYP2C9CYP3A4HDAC2 | |
| SCHEMBL6667112 | 0.95 | ESR2 (0.37) | ESR2ESR1CYP2C9CYP3A4HDAC2 | |
| SCHEMBL6667108 | 0.95 | ESR2 (0.37) | ESR2ESR1CYP2C9CYP3A4HDAC2 | |
| SCHEMBL6667110 | 0.95 | ESR2 (0.37) | ESR2ESR1CYP2C9CYP3A4HDAC2 | |
| SCHEMBL6663182 | 0.95 | ESR2 (0.32) | ESR2ESR1CYP2C9CYP3A4HDAC2 | |
| SCHEMBL6664001 | 0.94 | ESR2 (0.31) | ESR2 | |
| SCHEMBL6666457 | 0.94 | CYP2C9 (0.39) | ESR2CYP2C9HDAC2 |
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 1 patent. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-0893423-B1 | LIQUID CRYSTAL COMPOUNDS HAVING FLUORINATED LINKAGES, LIQUID CRYSTAL COMPOSITIONS, AND LIQUID CRYSTAL DISPLAY DEVICES | CHISSO CORP (JP) | 2004-09-01 | — | — | EP | disclosed |