⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL19409269 | 0.76 | — | — | |
| SCHEMBL17163986 | 0.74 | PDPK1 (0.41) | — | |
| SCHEMBL22941395 | 0.73 | — | — | |
| SCHEMBL19409242 | 0.73 | — | — | |
| SCHEMBL19409219 | 0.73 | GDA (0.41) | — | |
| SCHEMBL13348706 | 0.71 | — | — | |
| SCHEMBL6901153 | 0.70 | GDA (0.38) | — | |
| SCHEMBL19555386 | 0.70 | GDA (0.42) | — | |
| SCHEMBL12017486 | 0.69 | XDH (0.55) | — | |
| SCHEMBL12782649 | 0.69 | XDH (0.38) | — |
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 7 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-20170281501-A1 | 4,5-DIAMINOIMIDAZOLES AS NOVEL DEVELOPER-TYPE OXIDATION DYE PRECURSORS | HENKEL AG & CO. KGAA (DE) | 2017-10-05 | — | — | US | claimed |
| CN-1191485-A | Treatment and prevention of tumors with salts of aminoimidazole carboxamides and 5-amino or substituted amino 1,2, 3-triazoles | CONSTANTIA GROUPE CORP (AT) | 1998-08-26 | — | — | CN | claimed |
| US-20170281501-A1 | 4,5-DIAMINOIMIDAZOLES AS NOVEL DEVELOPER-TYPE OXIDATION DYE PRECURSORS | HENKEL AG & CO. KGAA (DE) | 2017-10-05 | — | — | US | disclosed |
| US-20170281501-A1 | 4,5-DIAMINOIMIDAZOLES AS NOVEL DEVELOPER-TYPE OXIDATION DYE PRECURSORS | HENKEL AG & CO. KGAA (DE) | 2017-10-05 | — | — | US | disclosed |
| US-20170281501-A1 | 4,5-DIAMINOIMIDAZOLES AS NOVEL DEVELOPER-TYPE OXIDATION DYE PRECURSORS | HENKEL AG & CO. KGAA (DE) | 2017-10-05 | — | — | US | disclosed |
| CN-101273988-B | Treatment and prevention of neoplasms with salts of aminoimidazole carboxamide and 5-amino or substituted amino 1,2,3-triazoles | TACTICAL THERAPEUTICS, INC. (US) | 2011-12-14 | — | — | CN | disclosed |
| CN-101273988-A | Treatment and prevention of neoplasms with salts of aminoimidazole carboxamide and 5-amino or substituted amino 1,2,3-triazoles | TACTICAL THERAPEUTICS INC (US) | 2008-10-01 | — | — | CN | disclosed |