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 | |
|---|---|---|---|---|
| SCHEMBL29315913 | 0.87 | ROCK1 (0.39) | ROCK2ROCK1 | |
| SCHEMBL29314121 | 0.77 | POLQ (0.44) | ROCK2ROCK1 | |
| SCHEMBL31009206 | 0.75 | ROCK2 (0.36) | ROCK2 | |
| SCHEMBL29316278 | 0.74 | NPBWR1 (0.39) | ROCK2ROCK1 | |
| SCHEMBL29315906 | 0.73 | NOTUM (0.47) | — | |
| SCHEMBL31648382 | 0.68 | POLQ (0.56) | — | |
| SCHEMBL29316276 | 0.65 | ROCK2 (0.39) | ROCK2ROCK1 | |
| SCHEMBL1296063 | 0.65 | HSP90AB1 (0.56) | — | |
| SCHEMBL31009157 | 0.64 | POLQ (0.46) | ROCK2ROCK1 | |
| SCHEMBL14661309 | 0.64 | P2RX7 (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 |
|---|---|---|---|---|---|---|---|
| WO-2024147972-A2 | DNA POLYMERASE THETA INHIBITORS CONTAINING NON-SATURATED 5-MEMBERED HETEROCYCLIC RINGS AND USE THEREOF | THOMAS JEFFERSON UNIVERSITY (US) | 2024-07-11 | — | — | WO | disclosed |