⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL22541334 | 0.85 | CDK1 (0.32) | — | |
| SCHEMBL4392989 | 0.79 | — | — | |
| SCHEMBL4379723 | 0.79 | TDP1 (0.40) | — | |
| SCHEMBL5322896 | 0.78 | HRH4 (0.32) | — | |
| SCHEMBL8934804 | 0.75 | — | — | |
| SCHEMBL181706 | 0.75 | — | — | |
| SCHEMBL4384776 | 0.73 | HRH4 (0.34) | — | |
| SCHEMBL7002161 | 0.73 | HIF1A (0.32) | — | |
| SCHEMBL7974888 | 0.72 | — | — | |
| SCHEMBL4379922 | 0.72 | — | — |
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 |
|---|---|---|---|---|---|---|---|
| EP-0760811-B1 | IMIDAZOLE DERIVATIVES AS HISTAMINE RECEPTOR H3 MODULATORS | INST NAT SANTE RECH MED (FR) | 2009-11-18 | — | — | EP | claimed |