Predicted protein targets (top 6)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TRPV3 | Q8NET8 | 1/20 | 0.33 |
| ▸ | ESR2 | Q92731 | 3/20 | 0.33 |
| ▸ | ESR1 | P03372 | 1/20 | 0.31 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.31 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.31 |
| ▸ | ALOX5 | P09917 | 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 | |
|---|---|---|---|---|
| SCHEMBL7030180 | 0.92 | TRPV3 (0.34) | TRPV3ESR2 | |
| SCHEMBL7032793 | 0.91 | ESR2 (0.39) | TRPV3ESR2ESR1CYP3A4CYP2C9 | |
| SCHEMBL7030314 | 0.89 | CYP2C9 (0.41) | ESR2CYP2C9 | |
| SCHEMBL7032816 | 0.87 | ESR2 (0.35) | ESR2CYP2C9 | |
| SCHEMBL7031562 | 0.85 | MEN1 (0.36) | ESR2CYP3A4CYP2C9 | |
| SCHEMBL7021664 | 0.83 | CYP2C9 (0.43) | ESR2ESR1CYP3A4CYP2C9 | |
| SCHEMBL7034366 | 0.83 | — | — | |
| SCHEMBL7031709 | 0.82 | ESR2 (0.36) | TRPV3ESR2ESR1CYP3A4CYP2C9 | |
| SCHEMBL7025913 | 0.82 | ESR2 (0.39) | TRPV3ESR2ESR1CYP3A4CYP2C9 | |
| SCHEMBL7030996 | 0.82 | NPC1 (0.32) | — |
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-0754668-B1 | Fluorobenzylether derivatives | ROLIC AG (CH) | 2003-02-05 | — | — | EP | disclosed |
| EP-0754668-A2 | Fluorobenzylether derivatives | Rolic AG (CH) | 1997-01-22 | — | — | EP | disclosed |