⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL9524 | 0.97 | — | — | |
| SCHEMBL20018526 | 0.97 | — | — | |
| Ammonia Solution, Strong SCHEMBL28412850 | 0.95 | — | — | |
| Hydrochloric Acid SCHEMBL16570059 | 0.95 | — | — | |
| Hydrochloric Acid SCHEMBL27573011 | 0.95 | — | — | |
| SCHEMBL9542986 | 0.88 | — | — | |
| Alcohol SCHEMBL28265620 | 0.86 | GBA1 (0.32) | — | |
| SCHEMBL22590342 | 0.82 | — | — | |
| SCHEMBL623203 | 0.82 | — | — | |
| SCHEMBL4376350 | 0.82 | — | — |
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-0255908-A2 | 7-[[3-(aminomethyl)-3-alkyl]-1-pyrrolidinyl]-quinoline-carboxylic acid-derivatives and pharmaceutical compositions containing them | WARNER-LAMBERT COMPANY (US) | 1988-02-17 | — | — | EP | disclosed |