Predicted protein targets (top 15)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HSD17B1 | P14061 | 9/20 | 0.37 |
| ▸ | HSD17B2 | P37059 | 9/20 | 0.37 |
| ▸ | APP | P05067 | 1/20 | 0.37 |
| ▸ | CYP3A4 | P08684 | 2/20 | 0.36 |
| ▸ | CYP2D6 | P10635 | 2/20 | 0.36 |
| ▸ | CYP2C19 | P33261 | 2/20 | 0.36 |
| ▸ | PDE3B | Q13370 | 3/20 | 0.36 |
| ▸ | PDE3A | Q14432 | 3/20 | 0.36 |
| ▸ | ENPP1 | P22413 | 1/20 | 0.35 |
| ▸ | AKR1C3 | P42330 | 2/20 | 0.35 |
| ▸ | AKR1C2 | P52895 | 2/20 | 0.35 |
| ▸ | ESR1 | P03372 | 1/20 | 0.34 |
| ▸ | ESR2 | Q92731 | 1/20 | 0.34 |
| ▸ | TRPV3 | Q8NET8 | 1/20 | 0.34 |
| ▸ | QPCT | Q16769 | 1/20 | 0.34 |
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 | |
|---|---|---|---|---|
| SCHEMBL22872107 | 0.90 | ESR1 (0.39) | HSD17B1HSD17B2PDE3BPDE3AAKR1C3 | |
| SCHEMBL22872126 | 0.86 | ESR1 (0.33) | PDE3BPDE3AENPP1AKR1C3AKR1C2 | |
| SCHEMBL22872110 | 0.82 | ESR1 (0.37) | HSD17B1HSD17B2PDE3BPDE3AESR1 | |
| SCHEMBL22872125 | 0.82 | ESR1 (0.40) | HSD17B1HSD17B2CYP3A4CYP2D6CYP2C19 | |
| SCHEMBL13742991 | 0.82 | ENPP1 (0.40) | HSD17B1HSD17B2APPCYP3A4CYP2D6 | |
| SCHEMBL22872105 | 0.81 | ENPP1 (0.39) | HSD17B1HSD17B2APPCYP3A4CYP2D6 | |
| SCHEMBL22872123 | 0.79 | PDE3B (0.37) | CYP3A4CYP2C19PDE3BPDE3AENPP1 | |
| SCHEMBL13967517 | 0.77 | PTGS2 (0.46) | APPCYP3A4CYP2C19PDE3BPDE3A | |
| SCHEMBL9319095 | 0.76 | APP (0.58) | APPPDE3BPDE3AAKR1C3AKR1C2 | |
| SCHEMBL27027638 | 0.75 | PDE3B (0.44) | HSD17B1HSD17B2CYP3A4CYP2D6CYP2C19 |
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 |