⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL8404931 | 0.97 | ALDH1A1 (0.32) | — | |
| SCHEMBL43224 | 0.97 | ALDH1A1 (0.32) | — | |
| SCHEMBL1444641 | 0.97 | — | — | |
| SCHEMBL926477 | 0.94 | — | — | |
| SCHEMBL2928473 | 0.75 | — | — | |
| SCHEMBL27686720 | 0.75 | DGAT1 (0.42) | — | |
| SCHEMBL9834517 | 0.73 | — | — | |
| SCHEMBL1514847 | 0.71 | — | — | |
| SCHEMBL3877861 | 0.71 | — | — | |
| SCHEMBL4762007 | 0.71 | — | — |
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-0203681-B1 | COMPRESSED POWDER FORMULATION CONTAINING ORGANOPHILIC CLAY AND A PROCESS FOR MAKING THE FORMULATION | RHEOX INTERNATIONAL, INC. (US) | 1991-05-02 | — | — | EP | disclosed |