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 | |
|---|---|---|---|---|
| SCHEMBL19199863 | 0.90 | PARP1 (0.79) | PARP1PARP2 | |
| SCHEMBL12822236 | 0.86 | PARP1 (0.65) | PARP1PARP2 | |
| SCHEMBL12822594 | 0.85 | PARP1 (0.64) | PARP1PARP2 | |
| SCHEMBL12822704 | 0.84 | PARP1 (0.59) | PARP1PARP2 | |
| SCHEMBL19200089 | 0.84 | PARP1 (0.62) | PARP1PARP2 | |
| SCHEMBL12822205 | 0.83 | PARP1 (0.62) | PARP1PARP2 | |
| SCHEMBL12822466 | 0.83 | PARP1 (0.60) | PARP1PARP2 | |
| SCHEMBL12822291 | 0.83 | PARP1 (0.57) | PARP1PARP2 | |
| SCHEMBL12822328 | 0.83 | PARP1 (0.62) | PARP1PARP2 | |
| SCHEMBL12822700 | 0.83 | PARP1 (0.60) | PARP1PARP2 |
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 |
|---|---|---|---|---|---|---|---|
| CN-110088098-B | Quinazolinone PARP-1 inhibitor and preparation method, pharmaceutical composition and application thereof | 中国医学科学院药物研究所 | 2022-04-15 | — | — | CN | disclosed |
| WO-2017128036-A1 | QUINAZOLINONE PARP-1 INHIBITOR AND PREPARATION METHOD, PHARMACEUTICAL COMPOSITION AND USE THEREOF | 中国医学科学院药物研究所 | 2017-08-03 | — | — | WO | disclosed |