⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL22807093 | 0.90 | — | — | |
| SCHEMBL21807796 | 0.90 | AURKA (0.35) | — | |
| SCHEMBL6650225 | 0.87 | AURKA (0.34) | — | |
| SCHEMBL630634 | 0.78 | HDAC6 (0.41) | — | |
| Hydrochloric Acid SCHEMBL7988951 | 0.76 | HDAC6 (0.40) | — | |
| SCHEMBL9419852 | 0.71 | HDAC6 (0.57) | — | |
| SCHEMBL3069732 | 0.70 | KDM4C (0.35) | — | |
| SCHEMBL18821909 | 0.69 | HDAC6 (0.45) | — | |
| SCHEMBL380666 | 0.69 | — | — | |
| SCHEMBL31408898 | 0.69 | AURKA (0.42) | — |
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 5 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-2142536-B1 | AMINOPYRIMIDINE DERIVATIVES AS GLUTAMINYL CYCLASE INHIBITORS | PROBIODRUG AG (DE) | 2015-10-21 | — | — | EP | disclosed |
| US-8188094-B2 | Imidazole derivatives; Alzheimer's Disease, Down syndrome and Huntington's Disease; hypotensive agents; sleeping and eating disorders, anxiolytic agents, antidepressants, antiepileptic agents; drug abuse/withdrawl; 1-(3,4-dimethoxyphenyl)-3-(3-(5-methyl-1H-imidazol-1-yl)propyl)thiourea | PROBIODRUG AG (DE) | 2012-05-29 | — | — | US | disclosed |
| EP-2142536-A1 | AMINOPYRIMIDINE DERIVATIVES AS GLUTAMINYL CYCLASE INHIBITORS | Probiodrug AG (DE) | 2010-01-13 | — | — | EP | disclosed |
| WO-2008128984-A1 | AMINOPYRIMIDINE DERIVATIVES AS GLUTAMINYL CYCLASE INHIBITORS | PROBIODRUG AG (DE) | 2008-10-30 | — | — | WO | disclosed |
| US-20080260688-A1 | NOVEL INHIBITORS OF GLUTAMINYL CYCLASE | PROBIODRUG AG (DE) | 2008-10-23 | — | — | US | disclosed |