⚠ Novel chemotype — no close known analogue (best Tanimoto < 0.3). Unexplored chemical space relative to ChEMBL.
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 | |
|---|---|---|---|---|
| SCHEMBL30983799 | 0.84 | PDPK1 (0.33) | — | |
| SCHEMBL30984104 | 0.72 | ADORA2A (0.34) | — | |
| Bromide SCHEMBL31626878 | 0.71 | ADORA2A (0.33) | — | |
| SCHEMBL31269071 | 0.67 | LIMK1 (0.33) | — | |
| SCHEMBL18274999 | 0.64 | CHEK1 (0.40) | — | |
| Adenine SCHEMBL13868060 | 0.60 | — | — | |
| SCHEMBL284829 | 0.59 | PDPK1 (0.52) | — | |
| SCHEMBL3388862 | 0.57 | KDM4E (0.40) | — | |
| SCHEMBL2940695 | 0.57 | PDPK1 (0.36) | — | |
| SCHEMBL31200352 | 0.55 | BRD4 (0.39) | — |
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-20250195530-A1 | POLQ INHIBITORS | ASTRAZENECA AB (SE) | 2025-06-19 | — | — | US | disclosed |