Predicted protein targets (top 6)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CCR2 | P41597 | 5/20 | 0.51 |
| ▸ | AR | P10275 | 2/20 | 0.47 |
| ▸ | PTGS2 | P35354 | 10/20 | 0.40 |
| ▸ | PTGS1 | P23219 | 9/20 | 0.40 |
| ▸ | ALOX5AP | P20292 | 1/20 | 0.36 |
| ▸ | FEN1 | P39748 | 1/20 | 0.36 |
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 | |
|---|---|---|---|---|
| SCHEMBL28076295 | 0.82 | CCR2 (0.48) | CCR2PTGS2PTGS1ALOX5APFEN1 | |
| SCHEMBL28830601 | 0.79 | PTGS2 (0.55) | CCR2PTGS2PTGS1 | |
| SCHEMBL28076284 | 0.78 | PTGS2 (0.42) | CCR2PTGS2PTGS1 | |
| SCHEMBL28076361 | 0.76 | CCR2 (0.50) | CCR2 | |
| SCHEMBL2774927 | 0.76 | CCR2 (0.50) | CCR2 | |
| SCHEMBL28076294 | 0.75 | PTGS1 (0.39) | PTGS2PTGS1ALOX5APFEN1 | |
| SCHEMBL25893221 | 0.72 | CCR2 (0.50) | CCR2AR | |
| SCHEMBL28830542 | 0.70 | CCR2 (0.47) | CCR2PTGS2PTGS1 | |
| SCHEMBL6725974 | 0.69 | PTGS2 (0.63) | PTGS2PTGS1 | |
| SCHEMBL1645034 | 0.68 | CA1 (0.47) | CCR2PTGS2PTGS1 |
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 4 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-103380115-B | Sulfur derivatives as chemokine receptor modulators | 阿勒根公司 | 2016-08-24 | — | — | CN | claimed |
| CN-106220618-B | Sulfur derivatives as chemokine receptor modulators | 阿勒根公司 | 2019-04-26 | — | — | CN | disclosed |
| CN-106220618-A | SULFUR DERIVATIVES AS CHEMOKINE RECEPTOR MODULATORS | 阿勒根公司 | 2016-12-14 | — | — | CN | disclosed |
| CN-103380115-B | Sulfur derivatives as chemokine receptor modulators | 阿勒根公司 | 2016-08-24 | — | — | CN | disclosed |