⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL28334108 | 0.90 | — | — | |
| SCHEMBL8813853 | 0.82 | ALDH1A1 (0.36) | — | |
| SCHEMBL7130482 | 0.77 | LMNA (0.32) | — | |
| SCHEMBL3089481 | 0.74 | CHRM1 (0.36) | — | |
| SCHEMBL443030 | 0.73 | MGAM (0.30) | — | |
| SCHEMBL28336563 | 0.72 | — | — | |
| SCHEMBL745932 | 0.71 | TP53 (0.33) | — | |
| SCHEMBL27589740 | 0.70 | — | — | |
| SCHEMBL5809591 | 0.70 | — | — | |
| SCHEMBL1584742 | 0.69 | LMNA (0.35) | — |
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-0480386-B1 | Polytetraalkylammonium and polytrialkylamine containing ligands bonded to inorganic supports and processes of using the same for removing and concentrating desired ions from solutions | UNIV BRIGHAM YOUNG (US) | 1996-01-03 | — | — | EP | claimed |