⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL1862378 | 1.00 | — | — | |
| SCHEMBL23787388 | 0.78 | ALDH1A1 (0.35) | — | |
| SCHEMBL12028769 | 0.78 | FOLH1 (0.32) | — | |
| SCHEMBL11639515 | 0.78 | ALDH1A1 (0.44) | — | |
| SCHEMBL3381910 | 0.77 | — | — | |
| SCHEMBL9195742 | 0.75 | — | — | |
| SCHEMBL10459252 | 0.75 | — | — | |
| SCHEMBL10454016 | 0.75 | — | — | |
| SCHEMBL8667515 | 0.75 | — | — | |
| SCHEMBL1130024 | 0.75 | — | — |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| WO-2000022153-A1 | METHOD FOR PREPARING 3-HYDROXYCARBOXYLIC ACIDS AND CAPTOPRIL | LONZA AG (CH) | 2000-04-20 | — | — | WO | disclosed |
| WO-2000022153-A1 | METHOD FOR PREPARING 3-HYDROXYCARBOXYLIC ACIDS AND CAPTOPRIL | LONZA AG (CH) | 2000-04-20 | — | — | WO | disclosed |