Predicted protein targets (top 3)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.35 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.32 |
| ▸ | SIGMAR1 | Q99720 | 1/20 | 0.30 |
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 | |
|---|---|---|---|---|
| SCHEMBL7741333 | 1.00 | ALDH1A1 (0.35) | ALDH1A1CYP1A2SIGMAR1 | |
| SCHEMBL18900922 | 1.00 | ALDH1A1 (0.35) | ALDH1A1CYP1A2SIGMAR1 | |
| Bicarbonate SCHEMBL9406812 | 0.91 | CASP1 (0.34) | — | |
| SCHEMBL2494000 | 0.86 | CYP1A2 (0.42) | CYP1A2SIGMAR1 | |
| SCHEMBL2502237 | 0.86 | CYP1A2 (0.42) | CYP1A2SIGMAR1 | |
| SCHEMBL2501008 | 0.86 | CYP1A2 (0.42) | CYP1A2SIGMAR1 | |
| SCHEMBL10597909 | 0.86 | CYP1A2 (0.42) | CYP1A2SIGMAR1 | |
| SCHEMBL546421 | 0.86 | CYP1A2 (0.42) | CYP1A2SIGMAR1 | |
| SCHEMBL11801552 | 0.84 | — | — | |
| SCHEMBL1287882 | 0.83 | — | — |
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 9 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| WO-2019115485-A1 | LIQUID-CRYSTALLINE MEDIUM | MERCK PATENT GMBH (DE) | 2019-06-20 | — | — | WO | disclosed |
| WO-2019110636-A1 | LIQUID-CRYSTALLINE MEDIUM | MERCK PATENT GMBH (DE) | 2019-06-13 | — | — | WO | disclosed |
| WO-2019101661-A1 | LIQUID CRYSTAL MEDIUM AND LIGHT MODULATION ELEMENT | MERCK PATENT GMBH (DE) | 2019-05-31 | — | — | WO | disclosed |
| EP-2837671-B1 | Liquid crystalline medium | MERCK PATENT GMBH (DE) | 2017-10-25 | — | — | EP | disclosed |
| EP-0891314-B1 | BISALKENYL DERIVATIVES, LIQUID CRYSTALLINE COMPOUNDS AND LIQUID CRYSTAL COMPOSITIONS | CHISSO CORP (JP) | 2001-09-05 | — | — | EP | disclosed |
| US-6180027-B1 | DISPLAY DEVICE | CHISSO CORPORATION (JP) | 2001-01-30 | — | — | US | disclosed |
| EP-0891314-A1 | BISALKENYL DERIVATIVES, LIQUID CRYSTALLINE COMPOUNDS AND LIQUID CRYSTAL COMPOSITIONS | CHISSO CORPORATION (JP) | 1999-01-20 | — | — | EP | disclosed |
| WO-1997034855-A1 | BISALKENYL DERIVATIVES, LIQUID CRYSTALLINE COMPOUNDS AND LIQUID CRYSTAL COMPOSITIONS | CHISSO CORPORATION (JP) | 1997-09-25 | — | — | WO | disclosed |
| EP-0331933-A2 | Liquid crystal mixture with a low optical anisotropy | F. HOFFMANN-LA ROCHE AG (CH) | 1989-09-13 | — | — | EP | disclosed |