Predicted protein targets (top 7)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | GPR84 | Q9NQS5 | 1/20 | 0.38 |
| ▸ | MAOB | P27338 | 3/20 | 0.34 |
| ▸ | MAOA | P21397 | 1/20 | 0.34 |
| ▸ | HRH3 | Q9Y5N1 | 2/20 | 0.32 |
| ▸ | BACE1 | P56817 | 1/20 | 0.32 |
| ▸ | ACACB | O00763 | 1/20 | 0.31 |
| ▸ | ACACA | Q13085 | 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 | |
|---|---|---|---|---|
| SCHEMBL8209357 | 1.00 | GPR84 (0.38) | GPR84MAOBMAOAHRH3BACE1 | |
| SCHEMBL8208635 | 0.91 | CYP2C9 (0.35) | GPR84MAOBMAOABACE1 | |
| SCHEMBL8209362 | 0.91 | CYP2C9 (0.40) | GPR84 | |
| SCHEMBL8215846 | 0.87 | RARB (0.38) | GPR84MAOBMAOA | |
| SCHEMBL8217592 | 0.87 | RARB (0.38) | GPR84MAOBMAOA | |
| SCHEMBL8220361 | 0.83 | CYP2C9 (0.38) | — | |
| SCHEMBL8208628 | 0.83 | SPHK1 (0.36) | HRH3 | |
| SCHEMBL8220723 | 0.83 | SPHK1 (0.36) | HRH3 | |
| SCHEMBL8219129 | 0.83 | RARB (0.34) | GPR84MAOBMAOA | |
| SCHEMBL8215809 | 0.83 | RARB (0.34) | GPR84MAOBMAOA |
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 |
|---|---|---|---|---|---|---|---|
| US-6117361-A | FOUR RING COMPOUND HAVING AN ALKYL GROUP SUBSTITUTED WITH ONE OR MORE ETHERS, AND A HALOGEN ATOM SUBSTITUTED BENZENE RING; BROAD TEMPERATURE RANGE OF NEMATIC PHASE, HIGHER MISCIBILITY WITH OTHER LIQUID CRYSTAL COMPOUNDS, AND CHEMICAL STABILITY | CHISSO CORP. (JP) | 2000-09-12 | — | — | US | disclosed |
| EP-0891961-A1 | LIQUID CRYSTAL COMPOUNDS HAVING FLUORINATED 1,4-PHENYLENE SKELETONS, LIQUID CRYSTAL COMPOSITIONS, AND LIQUID CRYSTAL DISPLAY DEVICES | CHISSO CORPORATION (JP) | 1999-01-20 | — | — | EP | disclosed |