Predicted protein targets (top 4)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CXCR2 | P25025 | 4/20 | 0.38 |
| ▸ | CCR6 | P51684 | 14/20 | 0.38 |
| ▸ | CXCR1 | P25024 | 3/20 | 0.36 |
| ▸ | SLC6A3 | Q01959 | 2/20 | 0.34 |
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 | |
|---|---|---|---|---|
| SCHEMBL2296772 | 1.00 | CXCR2 (0.38) | CXCR2CCR6CXCR1SLC6A3 | |
| SCHEMBL12205526 | 0.86 | CCR6 (0.52) | CXCR2CCR6 | |
| SCHEMBL2515883 | 0.86 | CCR6 (0.52) | CXCR2CCR6 | |
| SCHEMBL1580388 | 0.86 | CCR6 (0.52) | CXCR2CCR6 | |
| SCHEMBL2515881 | 0.86 | CCR6 (0.52) | CXCR2CCR6 | |
| SCHEMBL2515878 | 0.86 | CCR6 (0.52) | CXCR2CCR6 | |
| SCHEMBL2296009 | 0.86 | CXCR2 (0.47) | CXCR2CCR6CXCR1 | |
| SCHEMBL2296001 | 0.86 | CXCR2 (0.47) | CXCR2CCR6CXCR1 | |
| SCHEMBL2292676 | 0.79 | CXCR2 (0.63) | CXCR2CCR6 | |
| SCHEMBL12385834 | 0.79 | CXCR2 (0.63) | CXCR2CCR6 |
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 |
|---|---|---|---|---|---|---|---|
| US-7989497-B2 | Squaramide derivatives as CXCR2 antagonist | NOVARTIS AG (CH) | 2011-08-02 | — | — | US | claimed |