⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL7209199 | 0.87 | CPB2 (0.36) | — | |
| SCHEMBL24925524 | 0.80 | — | — | |
| SCHEMBL27772454 | 0.80 | — | — | |
| SCHEMBL27899099 | 0.78 | CSNK2A2 (0.33) | — | |
| Hydrochloric Acid SCHEMBL22833798 | 0.78 | KDM5A (0.40) | — | |
| SCHEMBL2982508 | 0.77 | CPB2 (0.43) | — | |
| SCHEMBL27744433 | 0.77 | ADORA2B (0.32) | — | |
| SCHEMBL1178918 | 0.76 | — | — | |
| SCHEMBL584318 | 0.76 | — | — | |
| SCHEMBL27800084 | 0.76 | — | — |
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-2022234271-A1 | HETEROARYL COMPOUNDS USEFUL IN THE TREATMENT OF COGNITIVE DISORDERS | UNIVERSITY COLLEGE CARDIFF CONSULTANTS LIMITED (GB) | 2022-11-10 | — | — | WO | disclosed |