Predicted protein targets (top 4)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ESR1 | P03372 | 1/20 | 0.31 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.31 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.31 |
| ▸ | ESR2 | Q92731 | 1/20 | 0.31 |
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 | |
|---|---|---|---|---|
| SCHEMBL6683178 | 1.00 | ESR1 (0.31) | ESR1CYP3A4CYP2C9ESR2 | |
| SCHEMBL2050249 | 0.93 | ESR1 (0.34) | ESR1CYP3A4CYP2C9ESR2 | |
| SCHEMBL6678892 | 0.93 | ESR1 (0.34) | ESR1CYP3A4CYP2C9ESR2 | |
| SCHEMBL10779317 | 0.82 | — | — | |
| SCHEMBL1512547 | 0.82 | ESR1 (0.31) | ESR1CYP3A4CYP2C9ESR2 | |
| SCHEMBL10888258 | 0.82 | — | — | |
| SCHEMBL1512545 | 0.82 | ESR1 (0.31) | ESR1CYP3A4CYP2C9ESR2 | |
| SCHEMBL10972851 | 0.82 | — | — | |
| SCHEMBL19339267 | 0.82 | ESR1 (0.31) | ESR1CYP3A4CYP2C9ESR2 | |
| SCHEMBL178487 | 0.82 | — | — |
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 2 patents. 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 |
| EP-0893423-A1 | LIQUID CRYSTAL COMPOUNDS HAVING FLUORINATED LINKAGES, LIQUID CRYSTAL COMPOSITIONS, AND LIQUID CRYSTAL DISPLAY DEVICES | CHISSO CORPORATION (JP) | 1999-01-27 | — | — | EP | disclosed |