Predicted protein targets (top 3)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CCR6 | P51684 | 18/20 | 0.68 |
| ▸ | CXCR1 | P25024 | 2/20 | 0.42 |
| ▸ | CXCR2 | P25025 | 2/20 | 0.42 |
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 | |
|---|---|---|---|---|
| SCHEMBL20761235 | 0.88 | CCR6 (0.68) | CCR6CXCR1CXCR2 | |
| SCHEMBL20721218 | 0.81 | CCR6 (1.00) | CCR6CXCR1CXCR2 | |
| SCHEMBL20760436 | 0.71 | CCR6 (0.71) | CCR6 | |
| SCHEMBL20721297 | 0.70 | CCR6 (1.00) | CCR6CXCR1CXCR2 | |
| SCHEMBL20761137 | 0.67 | CCR6 (0.69) | CCR6 | |
| SCHEMBL20760157 | 0.67 | CCR6 (0.68) | CCR6 | |
| SCHEMBL31114797 | 0.65 | CCR6 (0.65) | CCR6CXCR1CXCR2 | |
| SCHEMBL20760156 | 0.64 | CCR6 (0.69) | CCR6 | |
| SCHEMBL31114716 | 0.63 | CXCR2 (0.61) | CCR6CXCR1CXCR2 | |
| SCHEMBL24755299 | 0.63 | CCR6 (0.69) | CCR6CXCR1CXCR2 |
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 |
|---|---|---|---|---|---|---|---|
| WO-2019036374-A1 | 3,4-DISUBSTITUTED 3-CYCLOBUTENE-1,2-DIONES AND USE THEREOF | ALLERGAN, INC. (US) | 2019-02-21 | — | — | WO | disclosed |