⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL8600614 | 0.50 | — | — | |
| SCHEMBL8697717 | 0.47 | — | — | |
| Oxygen SCHEMBL15808690 | 0.39 | — | — | |
| Oxygen SCHEMBL28403189 | 0.39 | — | — | |
| SCHEMBL18575258 | 0.39 | — | — | |
| SCHEMBL3263250 | 0.39 | — | — | |
| SCHEMBL23245839 | 0.33 | — | — | |
| SCHEMBL556461 | 0.33 | — | — | |
| SCHEMBL5050354 | 0.33 | — | — | |
| SCHEMBL21642908 | 0.33 | — | — |
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-1991019700-A1 | PHARMACEUTICALLY ACTIVE BENZOQUINAZOLINE COMPOUNDS | THE WELLCOME FOUNDATION LIMITED (GB) | 1991-12-26 | — | — | WO | disclosed |