Predicted protein targets (top 3)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP2C9 | P11712 | 1/20 | 0.32 |
| ▸ | SPHK1 | Q9NYA1 | 2/20 | 0.31 |
| ▸ | AOC3 | Q16853 | 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 | |
|---|---|---|---|---|
| SCHEMBL22277325 | 0.94 | FFAR4 (0.33) | CYP2C9SPHK1AOC3 | |
| SCHEMBL22277614 | 0.93 | SPHK1 (0.35) | CYP2C9SPHK1 | |
| SCHEMBL22277694 | 0.90 | KDM1A (0.33) | CYP2C9 | |
| SCHEMBL22277621 | 0.89 | AOC3 (0.32) | SPHK1AOC3 | |
| SCHEMBL22277588 | 0.89 | SPHK1 (0.36) | CYP2C9SPHK1AOC3 | |
| SCHEMBL22277316 | 0.89 | CYP2C9 (0.37) | CYP2C9SPHK1 | |
| SCHEMBL22277634 | 0.87 | CNR2 (0.36) | CYP2C9SPHK1 | |
| SCHEMBL17154214 | 0.86 | HTR2A (0.30) | — | |
| SCHEMBL22277293 | 0.86 | HTR2A (0.30) | — | |
| SCHEMBL22277667 | 0.86 | NAAA (0.32) | SPHK1 |
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 |