⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL18509558 | 0.77 | — | — | |
| SCHEMBL18792547 | 0.77 | — | — | |
| SCHEMBL5425382 | 0.71 | — | — | |
| SCHEMBL18509468 | 0.70 | — | — | |
| SCHEMBL21004846 | 0.70 | ALDH1A1 (0.32) | — | |
| SCHEMBL18509301 | 0.70 | ALDH1A1 (0.32) | — | |
| SCHEMBL24343798 | 0.69 | — | — | |
| SCHEMBL25789535 | 0.69 | — | — | |
| SCHEMBL20997904 | 0.67 | — | — | |
| SCHEMBL18509768 | 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 1 patent. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-2684873-B1 | DRUGS FOR INHIBITING AGGREGATION OF PROTEINS INVOLVED IN DISEASES LINKED TO PROTEIN AGGREGATION AND/OR NEURODEGENERATIVE DISEASES | UNIV MUENCHEN LUDWIG MAXIMILIANS (DE) | 2019-01-16 | — | — | EP | disclosed |