⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL8114109 | 0.85 | — | — | |
| SCHEMBL8301150 | 0.84 | HTR7 (0.47) | — | |
| SCHEMBL27413348 | 0.81 | — | — | |
| SCHEMBL8303280 | 0.80 | — | — | |
| SCHEMBL8160035 | 0.80 | — | — | |
| SCHEMBL6218497 | 0.79 | — | — | |
| SCHEMBL8098927 | 0.78 | HTR7 (0.48) | — | |
| SCHEMBL2843971 | 0.78 | — | — | |
| SCHEMBL2843974 | 0.78 | — | — | |
| SCHEMBL8113020 | 0.78 | MEN1 (0.42) | — |
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 |
|---|---|---|---|---|---|---|---|
| EP-0934934-A2 | Methods of preparing substituted 3-phenyl- and 3-pyridyl-4(3H)-quinazolinones and atropisomers thereof | Pfizer Products Inc. (US) | 1999-08-11 | — | — | EP | disclosed |