⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL486376 | 0.59 | — | — | |
| SCHEMBL25072359 | 0.58 | — | — | |
| N-Methyl Pyrrolidine (Nmp) SCHEMBL13727063 | 0.57 | CTSL (0.35) | — | |
| SCHEMBL22872604 | 0.57 | L3MBTL1 (0.31) | — | |
| Iodide SCHEMBL4178239 | 0.57 | — | — | |
| SCHEMBL5708358 | 0.56 | — | — | |
| SCHEMBL2749519 | 0.54 | HRH3 (0.30) | — | |
| SCHEMBL9559860 | 0.54 | SMN1; SMN2 (0.33) | — | |
| SCHEMBL22920524 | 0.54 | L3MBTL1 (0.41) | — | |
| SCHEMBL22626251 | 0.54 | — | — |
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 |
|---|---|---|---|---|---|---|---|
| US-20090170734-A1 | NOVEL IMIDAZOLINIUM SALTS WITH LOW MELTING POINT, PROCESSES FOR PREPARATION THEREOF AND USE THEREOF AS A LUBRICANT | EVONIK DEGUSSA GMBH (DE) | 2009-07-02 | — | — | US | disclosed |