⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL56632 | 0.65 | — | — | |
| SCHEMBL583821 | 0.64 | — | — | |
| SCHEMBL83334 | 0.64 | — | — | |
| SCHEMBL6529739 | 0.64 | TRIM24 (0.44) | — | |
| SCHEMBL5376 | 0.64 | — | — | |
| SCHEMBL856125 | 0.62 | — | — | |
| SCHEMBL25405068 | 0.61 | HIF1A (0.43) | — | |
| Hydrochloric Acid SCHEMBL158082 | 0.61 | — | — | |
| SCHEMBL8607089 | 0.61 | HIF1A (0.43) | — | |
| Fluoride SCHEMBL22283826 | 0.61 | — | — |
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-7144887-B2 | Substituted 1,2,3-triazolo[1,5-a]quinazolines for enhancing cognition | MERCK SHARP & DOHME LTD. (GB) | 2006-12-05 | — | — | US | disclosed |