⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL1543593 | 0.64 | — | — | |
| SCHEMBL5601352 | 0.64 | — | — | |
| SCHEMBL726138 | 0.62 | AOC3 (0.44) | — | |
| SCHEMBL18428180 | 0.61 | KCNA5 (0.32) | — | |
| SCHEMBL18428184 | 0.58 | APLNR (0.41) | — | |
| SCHEMBL8269660 | 0.58 | LMNA (0.48) | — | |
| SCHEMBL11915432 | 0.58 | LMNA (0.48) | — | |
| SCHEMBL1068693 | 0.58 | LMNA (0.48) | — | |
| SCHEMBL20774859 | 0.58 | CDK2 (0.35) | — | |
| SCHEMBL23347704 | 0.57 | NISCH (0.42) | — |
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 3 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-0718288-B1 | Liquid hydrophobic salts, their preparation and their use in electrochemistry | HYDRO QUEBEC (CA) | 2005-06-29 | — | — | EP | disclosed |
| US-5683832-A | PHOTOVOLTAIC CELLS | ASULAB S.A. (CH) | 1997-11-04 | — | — | US | disclosed |
| EP-0718288-A1 | Liquid hydrophobic salts, their preparation and their use in electrochemistry | ASULAB S.A. (CH) | 1996-06-26 | — | — | EP | disclosed |