Predicted protein targets (top 2)
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 | |
|---|---|---|---|---|
| SCHEMBL19954979 | 0.83 | HCRTR1 (0.49) | HCRTR1HCRTR2 | |
| SCHEMBL665171 | 0.79 | PARP1 (0.58) | HCRTR1HCRTR2 | |
| SCHEMBL665626 | 0.76 | PARP1 (0.60) | HCRTR1HCRTR2 | |
| SCHEMBL665107 | 0.76 | PARP1 (0.47) | HCRTR1HCRTR2 | |
| SCHEMBL665994 | 0.74 | PARP1 (0.58) | HCRTR1HCRTR2 | |
| SCHEMBL10522199 | 0.74 | HRH4 (0.39) | HCRTR1HCRTR2 | |
| SCHEMBL15559527 | 0.74 | HCRTR1 (0.41) | HCRTR1HCRTR2 | |
| SCHEMBL16798917 | 0.72 | HCRTR1 (0.50) | HCRTR1HCRTR2 | |
| SCHEMBL16778810 | 0.71 | HCRTR1 (0.51) | HCRTR1HCRTR2 | |
| SCHEMBL4965847 | 0.71 | ALDH1A1 (0.43) | HCRTR1HCRTR2 |
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-9914721-B2 | Use of benzimidazole-proline derivatives | IDORSIA PHARMACEUTICALS LTD (CH) | 2018-03-13 | — | — | US | disclosed |