Predicted protein targets (top 5)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CCR2 | P41597 | 12/20 | 0.49 |
| ▸ | SLC6A3 | Q01959 | 2/20 | 0.36 |
| ▸ | SLC6A2 | P23975 | 1/20 | 0.36 |
| ▸ | SLC6A4 | P31645 | 1/20 | 0.36 |
| ▸ | OPRM1 | P35372 | 1/20 | 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 | |
|---|---|---|---|---|
| SCHEMBL1779891 | 0.90 | CCR2 (0.43) | CCR2SLC6A3SLC6A2SLC6A4OPRM1 | |
| SCHEMBL1829446 | 0.86 | CCR2 (0.42) | CCR2SLC6A3SLC6A2SLC6A4OPRM1 | |
| SCHEMBL1779892 | 0.82 | CCR2 (0.44) | CCR2SLC6A3SLC6A2SLC6A4OPRM1 | |
| SCHEMBL1782801 | 0.76 | CCR2 (0.62) | CCR2SLC6A3SLC6A2SLC6A4 | |
| SCHEMBL3222866 | 0.74 | CCR2 (0.36) | CCR2SLC6A3SLC6A2SLC6A4 | |
| SCHEMBL1779399 | 0.67 | CCR2 (0.55) | CCR2SLC6A3SLC6A2SLC6A4 | |
| SCHEMBL14237216 | 0.67 | CCR2 (1.00) | CCR2 | |
| SCHEMBL14237163 | 0.67 | CCR2 (1.00) | CCR2 | |
| SCHEMBL1826285 | 0.67 | CCR2 (1.00) | CCR2 | |
| SCHEMBL1781857 | 0.67 | CCR2 (1.00) | CCR2 |
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 3 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-8507559-B2 | Cyclohexenyl modulators of chemokine receptor activity | BRISTOL-MYERS SQUIBB COMPANY (US) | 2013-08-13 | — | — | US | disclosed |
| EP-2318352-B1 | CYCLOHEXENYL COMPOUNDS AS MODULATORS OF CHEMOKINE RECEPTOR ACTIVITY | BRISTOL MYERS SQUIBB CO (US) | 2012-12-19 | — | — | EP | disclosed |
| WO-2010009068-A2 | CYCLOHEXENYL MODULATORS OF CHEMOKINE RECEPTOR ACTIVITY | BRISTOL-MYERS SQUIBB COMPANY (US) | 2010-01-21 | — | — | WO | disclosed |