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 | |
|---|---|---|---|---|
| SCHEMBL19902407 | 0.92 | ROCK2 (0.51) | ROCK2ROCK1 | |
| SCHEMBL19902635 | 0.89 | ROCK2 (0.45) | ROCK2ROCK1 | |
| SCHEMBL20229914 | 0.88 | ROCK2 (0.44) | ROCK2ROCK1 | |
| SCHEMBL19902723 | 0.87 | ROCK2 (0.46) | ROCK2ROCK1 | |
| SCHEMBL17452972 | 0.81 | ROCK2 (0.53) | ROCK2ROCK1 | |
| SCHEMBL20229925 | 0.81 | PARP1 (0.41) | ROCK2ROCK1 | |
| SCHEMBL20229895 | 0.79 | PARP1 (0.41) | ROCK2 | |
| SCHEMBL19902380 | 0.78 | ROCK2 (0.62) | ROCK2ROCK1 | |
| SCHEMBL19902374 | 0.77 | ROCK2 (0.51) | ROCK2ROCK1 | |
| SCHEMBL20229926 | 0.77 | EZH2 (0.45) | — |
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-9902702-B2 | Spirocycloheptanes as inhibitors of rock | BRISTOL-MYERS SQUIBB COMPANY (US) | 2018-02-27 | — | — | US | disclosed |