Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CCR1 | P32246 | 1/20 | 0.44 |
| ▸ | CCR8 | P51685 | 1/20 | 0.44 |
| ▸ | NOS3 | P29474 | 1/20 | 0.41 |
| ▸ | NOS2 | P35228 | 1/20 | 0.41 |
| ▸ | SMN1; SMN2 | Q16637 | 3/20 | 0.41 |
| ▸ | KDM1A | O60341 | 1/20 | 0.38 |
| ▸ | MAOA | P21397 | 1/20 | 0.38 |
| ▸ | MAOB | P27338 | 1/20 | 0.38 |
| ▸ | MEN1 | O00255 | 4/20 | 0.37 |
| ▸ | KMT2A | Q03164 | 4/20 | 0.37 |
| ▸ | OPRM1 | P35372 | 1/20 | 0.37 |
| ▸ | OPRD1 | P41143 | 1/20 | 0.37 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.37 |
| ▸ | RAB9A | P51151 | 3/20 | 0.37 |
| ▸ | NPC1 | O15118 | 2/20 | 0.37 |
| ▸ | GRM5 | P41594 | 2/20 | 0.37 |
| ▸ | HDAC6 | Q9UBN7 | 2/20 | 0.37 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.37 |
| ▸ | CYP3A4 | P08684 | 2/20 | 0.37 |
| ▸ | CYP2D6 | P10635 | 2/20 | 0.37 |
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 | |
|---|---|---|---|---|
| SCHEMBL13879249 | 0.83 | NOS2 (0.43) | CCR1CCR8NOS3NOS2SMN1; SMN2 | |
| SCHEMBL247492 | 0.81 | SMN1; SMN2 (0.44) | CCR1CCR8NOS3NOS2SMN1; SMN2 | |
| SCHEMBL17429701 | 0.81 | CCR1 (0.43) | CCR1CCR8NOS3NOS2SMN1; SMN2 | |
| SCHEMBL21386765 | 0.79 | CCR1 (0.38) | CCR1CCR8NOS3NOS2SMN1; SMN2 | |
| SCHEMBL943326 | 0.77 | — | — | |
| SCHEMBL24916774 | 0.77 | CCR1 (0.52) | CCR1CCR8NOS3NOS2SMN1; SMN2 | |
| SCHEMBL14082023 | 0.77 | CCR1 (0.52) | CCR1CCR8NOS3NOS2SMN1; SMN2 | |
| SCHEMBL30201993 | 0.77 | CCR1 (0.52) | CCR1CCR8NOS3NOS2SMN1; SMN2 | |
| SCHEMBL526379 | 0.76 | CCR1 (0.39) | CCR1CCR8NOS3NOS2SMN1; SMN2 | |
| SCHEMBL526380 | 0.76 | CCR1 (0.39) | CCR1CCR8NOS3NOS2SMN1; SMN2 |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| WO-2011073269-A1 | PIPERIDINE ARYL SULFONAMIDE DERIVATIVES AS KV1.3 MODULATORS | EVOTEC AG (DE) | 2011-06-23 | — | — | WO | disclosed |
| WO-2011073276-A1 | BENZOXAZINE ARYL SULFONAMIDE DERIVATIVES AS KV1.3 MODULATORS | EVOTEC AG (DE) | 2011-06-23 | — | — | WO | disclosed |