Predicted protein targets (top 10)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | SPHK1 | Q9NYA1 | 13/20 | 0.43 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.39 |
| ▸ | SPHK2 | Q9NRA0 | 7/20 | 0.38 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.38 |
| ▸ | LMNA | P02545 | 1/20 | 0.38 |
| ▸ | MAPT | P10636 | 1/20 | 0.38 |
| ▸ | MEN1 | O00255 | 1/20 | 0.38 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.38 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.38 |
| ▸ | ESR2 | Q92731 | 1/20 | 0.35 |
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 | |
|---|---|---|---|---|
| SCHEMBL9480882 | 1.00 | SPHK1 (0.43) | SPHK1CYP2C9SPHK2ALDH1A1LMNA | |
| SCHEMBL10795072 | 0.90 | CYP2C9 (0.38) | SPHK1CYP2C9SPHK2ALDH1A1LMNA | |
| SCHEMBL10795067 | 0.90 | CYP2C9 (0.38) | SPHK1CYP2C9SPHK2ALDH1A1LMNA | |
| SCHEMBL9222275 | 0.88 | SPHK1 (0.47) | SPHK1CYP2C9SPHK2ALDH1A1LMNA | |
| SCHEMBL9222271 | 0.88 | SPHK1 (0.47) | SPHK1CYP2C9SPHK2ALDH1A1LMNA | |
| SCHEMBL23635471 | 0.87 | SPHK1 (0.49) | SPHK1CYP2C9SPHK2ALDH1A1LMNA | |
| SCHEMBL9458448 | 0.86 | SPHK1 (0.42) | SPHK1CYP2C9SPHK2ESR2 | |
| SCHEMBL9458444 | 0.86 | SPHK1 (0.42) | SPHK1CYP2C9SPHK2ESR2 | |
| SCHEMBL11280926 | 0.86 | SPHK1 (0.52) | SPHK1CYP2C9SPHK2ALDH1A1LMNA | |
| SCHEMBL6142274 | 0.85 | SPHK1 (0.37) | SPHK1CYP2C9SPHK2ALDH1A1LMNA |
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 5 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-5185098-A | Liquid crystalline mixtures containing 3,4-difluorophenyl-substituted bicyclohexyls | HOFFMANN-LA ROCHE INC. (US) | 1993-02-09 | — | — | US | disclosed |
| EP-0260450-B1 | LIQUID CRYSTAL DISPLAY | F. HOFFMANN-LA ROCHE AG (CH) | 1991-12-04 | — | — | EP | disclosed |
| US-4709030-A | 4-ALKENYL OR 2Z-ALKENYL POLYPHENYL COMPOUNDS; ELECTRO-OPTICS | HOFFMANN-LA ROCHE INC. (US) | 1987-11-24 | — | — | US | disclosed |
| US-4621901-A | ELECTROOPTICS | HOFFMANN-LA ROCHE INC. (US) | 1986-11-11 | — | — | US | disclosed |
| EP-0167912-A2 | Liquid crystal mixtures containing compounds with a 4-alkenyl or 2Z-alkenyl lateral chain | F. HOFFMANN-LA ROCHE AG (CH) | 1986-01-15 | — | — | EP | disclosed |