Predicted protein targets (top 3)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CCR6 | P51684 | 17/20 | 0.66 |
| ▸ | CXCR2 | P25025 | 2/20 | 0.41 |
| ▸ | POLB | P06746 | 1/20 | 0.40 |
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 | |
|---|---|---|---|---|
| SCHEMBL20760085 | 0.83 | CXCR2 (0.57) | CCR6CXCR2 | |
| SCHEMBL20721248 | 0.79 | CCR6 (1.00) | CCR6 | |
| SCHEMBL20760217 | 0.79 | CXCR2 (0.56) | CCR6CXCR2 | |
| SCHEMBL20761719 | 0.79 | CCR6 (0.66) | CCR6CXCR2 | |
| SCHEMBL20760283 | 0.77 | CCR6 (0.64) | CCR6 | |
| SCHEMBL20760381 | 0.77 | CCR6 (0.68) | CCR6CXCR2 | |
| SCHEMBL20760124 | 0.77 | CCR6 (0.68) | CCR6 | |
| SCHEMBL20760161 | 0.76 | GAA (0.51) | CCR6POLB | |
| SCHEMBL20760069 | 0.76 | CCR6 (0.69) | CCR6 | |
| SCHEMBL20760119 | 0.76 | CCR6 (0.66) | CCR6CXCR2 |
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 |