⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL8934801 | 0.81 | HRH3 (0.30) | — | |
| SCHEMBL793540 | 0.79 | — | — | |
| SCHEMBL8795856 | 0.78 | KCNH2 (0.33) | — | |
| SCHEMBL22533668 | 0.78 | HIF1A (0.33) | — | |
| SCHEMBL22541334 | 0.78 | CDK1 (0.32) | — | |
| SCHEMBL8309635 | 0.77 | — | — | |
| SCHEMBL469143 | 0.77 | KCNH2 (0.44) | — | |
| Water SCHEMBL29950724 | 0.77 | — | — | |
| SCHEMBL2696234 | 0.76 | KCNH2 (0.47) | — | |
| SCHEMBL2695561 | 0.76 | KCNH2 (0.47) | — |
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 |
|---|---|---|---|---|---|---|---|
| WO-1996029315-A2 | IMIDAZOLE DERIVATIVES AS HISTAMINE RECEPTOR H3 (ANT)AGONISTS | INSTITUT NATIONAL DE LA SANTE ET DE LA RECHERCHE MEDICALE (FR) | 1996-09-26 | — | — | WO | claimed |