⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL4659460 | 0.75 | — | — | |
| SCHEMBL11360076 | 0.72 | LMNA (0.32) | — | |
| SCHEMBL2569859 | 0.72 | LMNA (0.32) | — | |
| SCHEMBL8626895 | 0.71 | — | — | |
| SCHEMBL4662267 | 0.70 | — | — | |
| SCHEMBL9153978 | 0.70 | — | — | |
| SCHEMBL411683 | 0.64 | — | — | |
| SCHEMBL150828 | 0.64 | — | — | |
| SCHEMBL1170288 | 0.64 | — | — | |
| SCHEMBL21699 | 0.64 | — | — |
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 |
|---|---|---|---|---|---|---|---|
| US-4434178-A | ORGANOALUMINUM CHLORIDE COMPOUNDS | HOFFMANN-LA ROCHE, INC. (US) | 1984-02-28 | — | — | US | disclosed |
| EP-0049498-A1 | Aluminium compounds that contain an organic rest, anti-sudorific agent containing these compounds as active components and application of this agent as an anti-sudorific agent | Richardson-Vicks, Inc. (US) | 1982-04-14 | — | — | EP | disclosed |