Predicted protein targets (top 14)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ESR1 | P03372 | 3/20 | 0.39 |
| ▸ | ESR2 | Q92731 | 2/20 | 0.39 |
| ▸ | PDE3B | Q13370 | 4/20 | 0.37 |
| ▸ | PDE3A | Q14432 | 4/20 | 0.37 |
| ▸ | QPCT | Q16769 | 1/20 | 0.36 |
| ▸ | FEN1 | P39748 | 6/20 | 0.36 |
| ▸ | ALOX5AP | P20292 | 5/20 | 0.36 |
| ▸ | DHODH | Q02127 | 1/20 | 0.34 |
| ▸ | PDK2 | Q15119 | 1/20 | 0.34 |
| ▸ | AKR1C3 | P42330 | 1/20 | 0.34 |
| ▸ | AKR1C2 | P52895 | 1/20 | 0.34 |
| ▸ | HSD17B1 | P14061 | 1/20 | 0.33 |
| ▸ | HSD17B2 | P37059 | 1/20 | 0.33 |
| ▸ | CTSA | P10619 | 1/20 | 0.33 |
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 | |
|---|---|---|---|---|
| SCHEMBL22872106 | 0.90 | HSD17B1 (0.37) | ESR1ESR2PDE3BPDE3AQPCT | |
| SCHEMBL22872125 | 0.90 | ESR1 (0.40) | ESR1ESR2PDE3BPDE3AQPCT | |
| SCHEMBL22872126 | 0.87 | ESR1 (0.33) | ESR1ESR2PDE3BPDE3AQPCT | |
| SCHEMBL22872110 | 0.84 | ESR1 (0.37) | ESR1ESR2PDE3BPDE3AQPCT | |
| SCHEMBL12770292 | 0.82 | ESR1 (0.43) | ESR1ESR2PDE3BPDE3AFEN1 | |
| SCHEMBL22872109 | 0.79 | ESR2 (0.44) | ESR1ESR2PDE3BPDE3AFEN1 | |
| SCHEMBL22872123 | 0.78 | PDE3B (0.37) | PDE3BPDE3APDK2AKR1C3AKR1C2 | |
| SCHEMBL22872139 | 0.77 | RARB (0.40) | ESR1ESR2PDE3BPDE3AQPCT | |
| SCHEMBL22872114 | 0.77 | CYP11B1 (0.37) | PDE3BPDE3AQPCTPDK2HSD17B1 | |
| SCHEMBL14235283 | 0.75 | APP (0.55) | FEN1ALOX5APAKR1C3AKR1C2 |
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 3 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-4279565-A2 | THIOPHENE COMPOUND, LIQUID-CRYSTALLINE MEDIUM AND LIQUID-CRYSTAL DISPLAY COMPRISING THE SAME | Merck Patent GmbH (DE) | 2023-11-22 | — | — | EP | disclosed |
| US-11168255-B2 | Thiophene compound, liquid-crystalline medium and liquid-crystal display comprising the same | MERCK PATENT GMBH (DE) | 2021-11-09 | — | — | US | disclosed |
| EP-3763802-A1 | THIOPHENE COMPOUND, LIQUID-CRYSTALLINE MEDIUM AND LIQUID-CRYSTAL DISPLAY COMPRISING THE SAME | Merck Patent GmbH (DE) | 2021-01-13 | — | — | EP | disclosed |