Predicted protein targets (top 3)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.31 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.31 |
| ▸ | APLNR | P35414 | 1/20 | 0.30 |
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 | |
|---|---|---|---|---|
| SCHEMBL13274595 | 0.76 | CDK2 (0.35) | ALDH1A1SMN1; SMN2 | |
| SCHEMBL18865833 | 0.73 | ADORA3 (0.37) | ALDH1A1SMN1; SMN2 | |
| SCHEMBL14479077 | 0.70 | ADRB2 (0.32) | — | |
| SCHEMBL19069347 | 0.68 | PDE2A (0.33) | — | |
| SCHEMBL23107732 | 0.68 | CYP1A2 (0.43) | SMN1; SMN2 | |
| SCHEMBL24759408 | 0.67 | LMNA (0.33) | ALDH1A1SMN1; SMN2 | |
| SCHEMBL24469626 | 0.64 | CDK4 (0.34) | — | |
| SCHEMBL27701545 | 0.61 | KCNH2 (0.34) | — | |
| SCHEMBL13274469 | 0.61 | ADORA2A (0.35) | ALDH1A1 | |
| SCHEMBL8996368 | 0.61 | ALDH1A1 (0.39) | ALDH1A1SMN1; 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 1 patent. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| WO-2022099011-A1 | BICYCLIC 1,4-DIAZEPANONES AND THERAPEUTIC USES THEREOF | CYTOKINETICS, INC. (US) | 2022-05-12 | — | — | WO | disclosed |