Predicted protein targets (top 16)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP2C9 | P11712 | 2/20 | 0.36 |
| ▸ | ESR2 | Q92731 | 4/20 | 0.35 |
| ▸ | MAPT | P10636 | 2/20 | 0.35 |
| ▸ | MEN1 | O00255 | 2/20 | 0.35 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.35 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.35 |
| ▸ | LMNA | P02545 | 1/20 | 0.35 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.35 |
| ▸ | GAA | P10253 | 1/20 | 0.35 |
| ▸ | SPHK1 | Q9NYA1 | 4/20 | 0.34 |
| ▸ | DGAT1 | O75907 | 1/20 | 0.32 |
| ▸ | FFAR4 | Q5NUL3 | 1/20 | 0.32 |
| ▸ | OPRL1 | P41146 | 1/20 | 0.31 |
| ▸ | ESR1 | P03372 | 1/20 | 0.31 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.31 |
| ▸ | SPHK2 | Q9NRA0 | 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 | |
|---|---|---|---|---|
| SCHEMBL7033151 | 0.92 | CYP2C9 (0.44) | CYP2C9ESR2MAPTMEN1KMT2A | |
| SCHEMBL7031717 | 0.90 | CYP2C9 (0.36) | CYP2C9ESR2MAPTMEN1KMT2A | |
| SCHEMBL7026572 | 0.87 | CYP2C9 (0.36) | CYP2C9ESR2MAPTMEN1KMT2A | |
| SCHEMBL7025910 | 0.87 | ESR2 (0.35) | CYP2C9ESR2MAPTMEN1KMT2A | |
| SCHEMBL7026071 | 0.86 | RARB (0.39) | CYP2C9ESR2CYP3A4 | |
| SCHEMBL8029032 | 0.85 | CYP2C9 (0.41) | CYP2C9ESR2MAPTMEN1KMT2A | |
| SCHEMBL7508424 | 0.85 | CYP2C9 (0.41) | CYP2C9ESR2MAPTMEN1KMT2A | |
| SCHEMBL7026846 | 0.85 | CYP2C9 (0.33) | CYP2C9ESR2MAPTMEN1KMT2A | |
| SCHEMBL8388228 | 0.84 | MEN1 (0.33) | CYP2C9MAPTMEN1KMT2AGAA | |
| SCHEMBL7031561 | 0.84 | MEN1 (0.33) | CYP2C9MAPTMEN1KMT2AGAA |
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 |