⚠ 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 | |
|---|---|---|---|---|
| Hydrochloric Acid SCHEMBL4289619 | 0.83 | — | — | |
| SCHEMBL4282219 | 0.80 | RAB9A (0.38) | — | |
| SCHEMBL4285430 | 0.78 | GAA (0.42) | — | |
| SCHEMBL4289498 | 0.78 | TLR7 (0.39) | — | |
| SCHEMBL4290172 | 0.77 | GPR183 (0.46) | — | |
| SCHEMBL4288979 | 0.77 | GPR183 (0.47) | — | |
| SCHEMBL4285120 | 0.76 | NPC1 (0.39) | — | |
| SCHEMBL4281983 | 0.76 | L3MBTL1 (0.48) | — | |
| SCHEMBL18611964 | 0.76 | MAOB (0.52) | — | |
| SCHEMBL18591911 | 0.76 | MAOB (0.52) | — |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-20090227560-A1 | Substituted imidazole compound and use thereof | TAKEDA PHARMACEUTICAL COMPANY LIMITED (JP) | 2009-09-10 | — | — | US | disclosed |
| US-20090156612-A1 | Substituted imidazole compound and use thereof | TAKEDA PHARMACEUTICAL COMPANY LIMITED (JP) | 2009-06-18 | — | — | US | disclosed |