⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL12775755 | 0.74 | — | — | |
| SCHEMBL9299822 | 0.61 | CYP1A2 (0.37) | — | |
| SCHEMBL24514883 | 0.58 | DYRK1A (0.34) | — | |
| SCHEMBL7904164 | 0.57 | CCR1 (0.37) | — | |
| SCHEMBL25859750 | 0.56 | ALDH1A1 (0.33) | — | |
| SCHEMBL4953357 | 0.56 | DGAT1 (0.33) | — | |
| SCHEMBL14557162 | 0.56 | PDE10A (0.36) | — | |
| SCHEMBL23176060 | 0.55 | NPC1 (0.35) | — | |
| SCHEMBL12775671 | 0.55 | — | — | |
| SCHEMBL22728193 | 0.54 | COMT (0.44) | — |
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-3558465-A1 | ANHYDROUS SOLID COMPOSITION FOR DYEING KERATIN FIBRES COMPRISING A POLYMER COMPRISING AT LEAST ONE HETEROCYCLIC VINYL MONOMER | L'Oreal (FR) | 2019-10-30 | — | — | EP | disclosed |
| WO-2018114886-A1 | ANHYDROUS SOLID COMPOSITION FOR DYEING KERATIN FIBRES COMPRISING A POLYMER COMPRISING AT LEAST ONE HETEROCYCLIC VINYL MONOMER | L'OREAL (FR) | 2018-06-28 | — | — | WO | disclosed |
| WO-2016097124-A1 | COMPOSITION FOR DYEING OR LIGHTENING KERATIN FIBRES, IN THE FORM OF A MICROEMULSION BASED ON OIL(S) AND SURFACTANT(S) | L'OREAL (FR) | 2016-06-23 | — | — | WO | disclosed |
| WO-2011085140-A1 | THICKENED HAIR COLOURANT AND BLEACHING COMPOSITIONS | THE PROCTER & GAMBLE COMPANY (US) | 2011-07-14 | — | — | WO | disclosed |
| US-6231623-B1 | OXIDATIVE DYES | L'OREAL S.A. (FR) | 2001-05-15 | — | — | US | disclosed |