Predicted protein targets (top 6)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | THRB | P10828 | 8/20 | 0.49 |
| ▸ | THRA | P10827 | 1/20 | 0.44 |
| ▸ | GPR84 | Q9NQS5 | 8/20 | 0.43 |
| ▸ | SCN9A | Q15858 | 2/20 | 0.42 |
| ▸ | SCN5A | Q14524 | 1/20 | 0.42 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.41 |
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 | |
|---|---|---|---|---|
| SCHEMBL10695294 | 1.00 | THRB (0.49) | THRBTHRAGPR84SCN9ASCN5A | |
| SCHEMBL10688587 | 1.00 | THRB (0.49) | THRBTHRAGPR84SCN9ASCN5A | |
| SCHEMBL10689918 | 1.00 | THRB (0.49) | THRBTHRAGPR84SCN9ASCN5A | |
| SCHEMBL10686669 | 1.00 | THRB (0.49) | THRBTHRAGPR84SCN9ASCN5A | |
| SCHEMBL10692218 | 1.00 | THRB (0.49) | THRBTHRAGPR84SCN9ASCN5A | |
| SCHEMBL10695147 | 1.00 | THRB (0.49) | THRBTHRAGPR84SCN9ASCN5A | |
| SCHEMBL10692891 | 1.00 | THRB (0.49) | THRBTHRAGPR84SCN9ASCN5A | |
| SCHEMBL10690286 | 1.00 | THRB (0.49) | THRBTHRAGPR84SCN9ASCN5A | |
| SCHEMBL10692323 | 1.00 | THRB (0.49) | THRBTHRAGPR84SCN9ASCN5A | |
| SCHEMBL10692683 | 0.97 | THRB (0.46) | THRBTHRAGPR84SCN9ASCN5A |
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 |
|---|---|---|---|---|---|---|---|
| US-4734522-A | LIQUID CRYSTALS | MERCK PATENT GESELLSCHAFT MIT BESCHRANKTER HAFTUNG (DE) | 1988-03-29 | — | — | US | disclosed |
| US-4578210-A | Carbocyclic six-membered ring compounds | MERCK PATENT GESELLSCHAFT MIT BESCHRANKTER HAFTUNG (DE) | 1986-03-25 | — | — | US | disclosed |
| EP-0134576-A2 | Carbocyclic six-membered ring compounds | MERCK PATENT GmbH (DE) | 1985-03-20 | — | — | EP | disclosed |