Predicted protein targets (top 10)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | S1PR1 | P21453 | 1/20 | 0.48 |
| ▸ | DRD3 | P35462 | 6/20 | 0.41 |
| ▸ | DRD2 | P14416 | 5/20 | 0.41 |
| ▸ | KCNH2 | Q12809 | 4/20 | 0.41 |
| ▸ | KMO | O15229 | 1/20 | 0.40 |
| ▸ | DPP4 | P27487 | 1/20 | 0.40 |
| ▸ | AR | P10275 | 5/20 | 0.39 |
| ▸ | NR3C2 | P08235 | 1/20 | 0.38 |
| ▸ | HDAC1 | Q13547 | 1/20 | 0.38 |
| ▸ | LARS1 | Q9P2J5 | 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 | |
|---|---|---|---|---|
| SCHEMBL7272892 | 0.88 | DRD3 (0.39) | S1PR1DRD3DRD2KCNH2DPP4 | |
| SCHEMBL7284086 | 0.87 | S1PR1 (0.48) | S1PR1DRD3DRD2KCNH2DPP4 | |
| SCHEMBL7275516 | 0.83 | S1PR1 (0.55) | S1PR1DRD3DRD2KCNH2KMO | |
| SCHEMBL7274500 | 0.83 | DRD3 (0.41) | DRD3DRD2KCNH2ARLARS1 | |
| SCHEMBL7282539 | 0.80 | S1PR1 (0.47) | S1PR1DRD3DRD2KCNH2HDAC1 | |
| Hydrochloric Acid SCHEMBL8557146 | 0.76 | S1PR1 (0.53) | S1PR1DRD3DRD2KCNH2DPP4 | |
| SCHEMBL7276480 | 0.76 | DRD3 (0.46) | S1PR1DRD3DRD2KCNH2DPP4 | |
| SCHEMBL7281185 | 0.75 | S1PR1 (0.49) | S1PR1DRD3DRD2KCNH2DPP4 | |
| SCHEMBL7274054 | 0.75 | S1PR1 (0.62) | S1PR1DRD3DRD2HDAC1LARS1 | |
| SCHEMBL7281337 | 0.74 | S1PR1 (0.48) | S1PR1DRD3DRD2KCNH2DPP4 |
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 5 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-5852192-A | Cyclic urea derivatives, pharmaceutical compositions containing these compounds and processes for preparing them | DR. KARL THOMAE GMBH (DE) | 1998-12-22 | — | — | US | disclosed |
| EP-0503548-B1 | Cyclic urea derivatives, medicaments contaning them and process for their preparation | THOMAE GMBH DR K (DE) | 1997-06-04 | — | — | EP | disclosed |
| US-5478942-A | Antiinflammatory agents, antiagglomerants | KARL THOMAE GMBH (DE) | 1995-12-26 | — | — | US | disclosed |
| US-5276049-A | Treatment of thrombosis | DR. KARL THOMAE GMBH (DE) | 1994-01-04 | — | — | US | disclosed |
| EP-0503548-A1 | Cyclic urea derivatives, medicaments contaning them and process for their preparation | Dr. Karl Thomae GmbH (DE) | 1992-09-16 | — | — | EP | disclosed |