⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL8934768 | 0.86 | — | — | |
| SCHEMBL4385141 | 0.86 | HRH3 (0.34) | — | |
| SCHEMBL4385056 | 0.84 | HRH3 (0.32) | — | |
| SCHEMBL4376138 | 0.83 | HRH3 (0.32) | — | |
| SCHEMBL4386652 | 0.82 | HRH3 (0.31) | — | |
| SCHEMBL18400717 | 0.81 | ACE2 (0.34) | — | |
| SCHEMBL439550 | 0.80 | HIF1A (0.35) | — | |
| SCHEMBL4379813 | 0.78 | — | — | |
| SCHEMBL7991263 | 0.78 | HRH3 (0.33) | — | |
| SCHEMBL7977343 | 0.76 | HRH3 (0.32) | — |
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 | disclosed |