Predicted protein targets (top 9)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CCR2 | P41597 | 13/20 | 0.40 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.36 |
| ▸ | MEN1 | O00255 | 1/20 | 0.36 |
| ▸ | EPHX2 | P34913 | 1/20 | 0.35 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.34 |
| ▸ | RAB9A | P51151 | 1/20 | 0.32 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.32 |
| ▸ | MAPT | P10636 | 1/20 | 0.32 |
| ▸ | KMO | O15229 | 1/20 | 0.32 |
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 | |
|---|---|---|---|---|
| SCHEMBL1779901 | 0.88 | MEN1 (0.37) | CCR2KMT2AMEN1EPHX2ALDH1A1 | |
| SCHEMBL3233210 | 0.82 | CCR2 (0.49) | CCR2ALDH1A1 | |
| SCHEMBL3235269 | 0.76 | CCR2 (0.40) | CCR2KMT2AMEN1EPHX2ALDH1A1 | |
| SCHEMBL1779902 | 0.73 | CCR2 (0.40) | CCR2KMT2AMEN1EPHX2ALDH1A1 | |
| SCHEMBL1781978 | 0.71 | CCR2 (0.42) | CCR2KMT2AMEN1ALDH1A1SMN1; SMN2 | |
| SCHEMBL1779888 | 0.68 | MEN1 (0.37) | CCR2KMT2AMEN1EPHX2ALDH1A1 | |
| SCHEMBL1781951 | 0.68 | CCR2 (0.81) | CCR2 | |
| Bicarbonate SCHEMBL14237079 | 0.68 | CCR2 (0.47) | CCR2KMT2AMEN1KMO | |
| SCHEMBL1780501 | 0.67 | CCR2 (0.47) | CCR2KMT2AMEN1ALDH1A1RAB9A | |
| SCHEMBL1779889 | 0.66 | CCR2 (0.40) | CCR2KMT2AMEN1EPHX2ALDH1A1 |
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 |