Predicted protein targets (top 7)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | SPHK1 | Q9NYA1 | 13/20 | 0.38 |
| ▸ | SPHK2 | Q9NRA0 | 7/20 | 0.36 |
| ▸ | ESR2 | Q92731 | 3/20 | 0.36 |
| ▸ | CYP2C9 | P11712 | 2/20 | 0.34 |
| ▸ | ESR1 | P03372 | 1/20 | 0.34 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.34 |
| ▸ | HDAC2 | Q92769 | 1/20 | 0.33 |
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 | |
|---|---|---|---|---|
| SCHEMBL9625431 | 1.00 | SPHK1 (0.38) | SPHK1SPHK2ESR2CYP2C9ESR1 | |
| SCHEMBL9625599 | 0.95 | SPHK1 (0.36) | SPHK1SPHK2ESR2CYP2C9ESR1 | |
| SCHEMBL9625604 | 0.95 | SPHK1 (0.36) | SPHK1SPHK2ESR2CYP2C9ESR1 | |
| SCHEMBL9625346 | 0.88 | SPHK1 (0.46) | SPHK1SPHK2CYP2C9 | |
| SCHEMBL9625349 | 0.88 | SPHK1 (0.46) | SPHK1SPHK2CYP2C9 | |
| SCHEMBL9625144 | 0.85 | SPHK1 (0.54) | SPHK1SPHK2 | |
| SCHEMBL9625148 | 0.85 | SPHK1 (0.54) | SPHK1SPHK2 | |
| SCHEMBL8450445 | 0.84 | KDM4E (0.38) | SPHK1SPHK2ESR2CYP2C9ESR1 | |
| SCHEMBL9626535 | 0.84 | SPHK1 (0.43) | SPHK1SPHK2CYP2C9 | |
| SCHEMBL9625107 | 0.84 | SPHK1 (0.59) | SPHK1SPHK2ESR1CYP3A4 |
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-0325796-B1 | A LIQUID CRYSTAL COMPOUND AND A MIXTURE CONTAINING THE SAME | Chisso Corporation (JP) | 1992-03-11 | — | — | EP | disclosed |
| US-4877548-A | STABLE TO HEAT, LIGHT, ELECTRICITY AND MOISTURE | CHISSO CORPORATION (JP) | 1989-10-31 | — | — | US | disclosed |
| EP-0325796-A1 | A liquid crystal compound and a mixture containing the same | Chisso Corporation (JP) | 1989-08-02 | — | — | EP | disclosed |