⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL7263753 | 0.64 | NNMT (0.33) | — | |
| SCHEMBL16995204 | 0.63 | — | — | |
| SCHEMBL15940501 | 0.62 | — | — | |
| SCHEMBL18327710 | 0.61 | — | — | |
| SCHEMBL22782117 | 0.59 | — | — | |
| SCHEMBL17348508 | 0.59 | — | — | |
| SCHEMBL10840231 | 0.57 | — | — | |
| SCHEMBL17993883 | 0.57 | — | — | |
| SCHEMBL20124453 | 0.57 | — | — | |
| SCHEMBL18327842 | 0.57 | — | — |
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-0597956-A1 | QUINAZOLINE DERIVATIVES AS ACETYLCHOLINESTERASE INHIBITORS | WARNER-LAMBERT COMPANY (US) | 1994-05-25 | — | — | EP | disclosed |