Predicted protein targets (top 4)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CCR6 | P51684 | 3/20 | 0.56 |
| ▸ | CXCR2 | P25025 | 17/20 | 0.55 |
| ▸ | CXCR1 | P25024 | 12/20 | 0.51 |
| ▸ | CCR7 | P32248 | 1/20 | 0.47 |
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 | |
|---|---|---|---|---|
| SCHEMBL12263771 | 0.89 | CCR6 (0.73) | CCR6CXCR2CXCR1CCR7 | |
| SCHEMBL12087141 | 0.85 | CCR6 (0.76) | CCR6CXCR2CXCR1CCR7 | |
| SCHEMBL12263692 | 0.78 | CCR6 (0.77) | CCR6CXCR2CXCR1CCR7 | |
| SCHEMBL12262198 | 0.78 | CXCR2 (0.76) | CXCR2CXCR1 | |
| SCHEMBL14511432 | 0.77 | CXCR2 (0.78) | CXCR2CXCR1 | |
| SCHEMBL14511505 | 0.76 | CXCR2 (0.76) | CXCR2CXCR1 | |
| SCHEMBL14511438 | 0.76 | CXCR2 (0.58) | CCR6CXCR2CXCR1CCR7 | |
| SCHEMBL14511603 | 0.76 | CXCR2 (0.58) | CCR6CXCR2CXCR1CCR7 | |
| SCHEMBL12087145 | 0.75 | CCR6 (0.77) | CCR6CXCR2CXCR1CCR7 | |
| SCHEMBL12087153 | 0.74 | CXCR2 (0.74) | CCR6CXCR2CXCR1 |
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 1 patent. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-1539678-B1 | 3,4-DI-SUBSTITUTED CYCLOBUTENE-1, 2-DIONES AS CXC-CHEMOKINE RECEPTOR LIGANDS | MERCK SHARP & DOHME (US) | 2012-09-05 | — | — | EP | disclosed |