Predicted protein targets (top 11)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | SPHK1 | Q9NYA1 | 13/20 | 0.48 |
| ▸ | SPHK2 | Q9NRA0 | 7/20 | 0.43 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.36 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.35 |
| ▸ | LMNA | P02545 | 1/20 | 0.35 |
| ▸ | MAPT | P10636 | 1/20 | 0.35 |
| ▸ | MAOA | P21397 | 1/20 | 0.35 |
| ▸ | MAOB | P27338 | 1/20 | 0.35 |
| ▸ | MEN1 | O00255 | 1/20 | 0.35 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.35 |
| ▸ | KMT2A | Q03164 | 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 | |
|---|---|---|---|---|
| SCHEMBL22277672 | 0.93 | SPHK1 (0.48) | SPHK1SPHK2CYP2C9ALDH1A1LMNA | |
| SCHEMBL22277678 | 0.93 | SPHK1 (0.40) | SPHK1SPHK2CYP2C9ALDH1A1LMNA | |
| SCHEMBL22277297 | 0.89 | SPHK1 (0.43) | SPHK1SPHK2CYP2C9ALDH1A1LMNA | |
| SCHEMBL22277670 | 0.88 | SPHK1 (0.42) | SPHK1SPHK2CYP2C9ALDH1A1LMNA | |
| SCHEMBL22277309 | 0.87 | SPHK1 (0.46) | SPHK1SPHK2CYP2C9 | |
| SCHEMBL22277740 | 0.87 | SPHK1 (0.38) | SPHK1SPHK2 | |
| SCHEMBL22277533 | 0.86 | SPHK1 (0.45) | SPHK1SPHK2 | |
| SCHEMBL22277657 | 0.85 | SPHK1 (0.40) | SPHK1SPHK2CYP2C9ALDH1A1LMNA | |
| SCHEMBL22277588 | 0.85 | SPHK1 (0.36) | SPHK1SPHK2CYP2C9ALDH1A1LMNA | |
| SCHEMBL10761970 | 0.84 | SPHK1 (0.55) | SPHK1SPHK2CYP2C9ALDH1A1LMNA |
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 1 patent. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-20200239775-A1 | TETRACYCLIC LIQUID CRYSTAL COMPOUND HAVING DIATOMIC BONDING GROUP AND 2,3-DIFLUOROPHENYLENE, LIQUID CRYSTAL COMPOSITION AND LIQUID CRYSTAL DISPLAY DEVICE | JNC CORPORATION (JP) | 2020-07-30 | — | — | US | disclosed |