⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL5163037 | 0.83 | TSHR (0.32) | — | |
| SCHEMBL2923881 | 0.80 | TSHR (0.34) | — | |
| SCHEMBL5163069 | 0.79 | HTR2A (0.36) | — | |
| SCHEMBL4730393 | 0.78 | HTR2A (0.41) | — | |
| Hydrochloric Acid SCHEMBL6757419 | 0.78 | TSHR (0.33) | — | |
| SCHEMBL5403662 | 0.77 | SMN1; SMN2 (0.34) | — | |
| Bromide SCHEMBL5848621 | 0.76 | HTR2A (0.40) | — | |
| SCHEMBL3943493 | 0.76 | TSHR (0.34) | — | |
| SCHEMBL3944376 | 0.76 | TSHR (0.32) | — | |
| SCHEMBL5383378 | 0.76 | SRC (0.34) | — |
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 |
|---|---|---|---|---|---|---|---|
| EP-1406874-B1 | COMPOUNDS DERIVED FROM DIAMINOPYRAZOLES SUBSTITUTED BY AN AMINOALKYL OR AMINOALKENYL RADICAL AND THEIR USE IN OXIDATION DYEING OF KERATINOUS FIBRES | OREAL (FR) | 2007-03-28 | — | — | EP | claimed |
| US-7014663-B2 | Compounds derived from diaminopyrazoles substituted by an aminoalkyl or aminoalkenyl radical and their use in oxidation dyeing of keratinous fibres | L'OREAL (FR) | 2006-03-21 | — | — | US | claimed |
| US-20050015893-A1 | Compounds derived from diaminopyrazoles substituted by an aminoalkyl or aminoalkenyl radical and their use in oxidation dyeing of keratinous fibres | L'OREAL (FR) | 2005-01-27 | — | — | US | claimed |
| EP-1406874-A1 | COMPOUNDS DERIVED FROM DIAMINOPYRAZOLES SUBSTITUTED BY AN AMINOALKYL OR AMINOALKENYL RADICAL AND THEIR USE IN OXIDATION DYEING OF KERATINOUS FIBRES | L'OREAL (FR) | 2004-04-14 | — | — | EP | claimed |
| WO-2003008385-A1 | COMPOUNDS DERIVED FROM DIAMINOPYRAZOLES SUBSTITUTED BY AN AMINOALKYL OR AMINOALKENYL RADICAL AND THEIR USE IN OXIDATION DYEING OF KERATINOUS FIBRES | L'OREAL (FR) | 2003-01-30 | — | — | WO | claimed |
| US-7014663-B2 | Compounds derived from diaminopyrazoles substituted by an aminoalkyl or aminoalkenyl radical and their use in oxidation dyeing of keratinous fibres | L'OREAL (FR) | 2006-03-21 | — | — | US | disclosed |
| US-20050015893-A1 | Compounds derived from diaminopyrazoles substituted by an aminoalkyl or aminoalkenyl radical and their use in oxidation dyeing of keratinous fibres | L'OREAL (FR) | 2005-01-27 | — | — | US | disclosed |