Predicted protein targets (top 8)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PDE4D | Q08499 | 18/20 | 0.43 |
| ▸ | PDE4A | P27815 | 13/20 | 0.43 |
| ▸ | PDE4B | Q07343 | 13/20 | 0.43 |
| ▸ | PDE4C | Q08493 | 13/20 | 0.43 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.38 |
| ▸ | GAA | P10253 | 1/20 | 0.38 |
| ▸ | F11 | P03951 | 1/20 | 0.37 |
| ▸ | KLKB1 | P03952 | 1/20 | 0.37 |
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 | |
|---|---|---|---|---|
| SCHEMBL7793105 | 0.97 | PDE4D (0.43) | PDE4DPDE4APDE4BPDE4CALDH1A1 | |
| SCHEMBL7793070 | 0.94 | PDE4D (0.48) | PDE4DPDE4APDE4BPDE4CALDH1A1 | |
| SCHEMBL7798881 | 0.92 | PDE4D (0.44) | PDE4DPDE4APDE4BPDE4CALDH1A1 | |
| SCHEMBL7802792 | 0.92 | PDE4D (0.44) | PDE4DPDE4APDE4BPDE4C | |
| SCHEMBL7798692 | 0.92 | PDE4D (0.44) | PDE4DPDE4APDE4BPDE4C | |
| SCHEMBL7798791 | 0.91 | PDE4D (0.43) | PDE4DPDE4APDE4BPDE4CALDH1A1 | |
| SCHEMBL7793257 | 0.91 | PDE4D (0.43) | PDE4DPDE4APDE4BPDE4CALDH1A1 | |
| SCHEMBL7800692 | 0.91 | PDE4D (0.43) | PDE4DPDE4APDE4BPDE4C | |
| SCHEMBL8180776 | 0.91 | PDE4D (0.43) | PDE4DPDE4APDE4BPDE4C | |
| SCHEMBL7800785 | 0.91 | PDE4D (0.44) | PDE4DPDE4APDE4BPDE4CALDH1A1 |
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 4 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-0723962-B1 | Arylalkyl-thiadiazinones | MERCK PATENT GMBH (DE) | 2001-07-04 | — | — | EP | disclosed |
| US-6025354-A | Arylalkyl-thiadiazinones | MERCK PATENT GESELLSCHAFT MIT BESCHRANKTER HAFTUNG (DE) | 2000-02-15 | — | — | US | disclosed |
| US-5747489-A | Arylalkyl-thiadiazinones | MERCK PATENT GESELLSCHAFT MIT BESCHRANKTER HAFTUNG (DE) | 1998-05-05 | — | — | US | disclosed |
| EP-0723962-A1 | Arylalkyl-thiadiazinones | MERCK PATENT GmbH (DE) | 1996-07-31 | — | — | EP | disclosed |