⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL8043393 | 0.72 | — | — | |
| SCHEMBL1381917 | 0.72 | — | — | |
| SCHEMBL88328 | 0.72 | — | — | |
| SCHEMBL88927 | 0.72 | — | — | |
| Hydrochloric Acid SCHEMBL7803378 | 0.69 | — | — | |
| SCHEMBL11410418 | 0.67 | ALDH1A1 (0.35) | — | |
| SCHEMBL973748 | 0.67 | — | — | |
| SCHEMBL11808315 | 0.67 | — | — | |
| SCHEMBL461838 | 0.67 | — | — | |
| SCHEMBL1835957 | 0.67 | — | — |
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 |
|---|---|---|---|---|---|---|---|
| EP-0799296-A2 | USE OF HYDROXYALKYLAMINOCARBOXYLIC ACIDS AS COMPLEXING AGENTS | BASF AKTIENGESELLSCHAFT (DE) | 1997-10-08 | — | — | EP | disclosed |
| WO-1996019557-A2 | USE OF HYDROXYALKYLAMINOCARBOXYLIC ACIDS AS COMPLEXING AGENTS | BASF AKTIENGESELLSCHAFT (DE) | 1996-06-27 | — | — | WO | disclosed |