⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL4413974 | 0.81 | — | — | |
| SCHEMBL4414845 | 0.78 | KMT2A (0.45) | — | |
| SCHEMBL4405936 | 0.76 | SLC9A1 (0.42) | — | |
| SCHEMBL4405543 | 0.75 | CNR2 (0.41) | — | |
| SCHEMBL4411145 | 0.74 | SLC9A1 (0.44) | — | |
| SCHEMBL2163916 | 0.72 | — | — | |
| SCHEMBL13327698 | 0.71 | — | — | |
| SCHEMBL4631233 | 0.70 | — | — | |
| SCHEMBL8131048 | 0.70 | — | — | |
| SCHEMBL6358213 | 0.70 | — | — |
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 4 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-102320998-B | Phthalic diamide compounds containing 2'-hydroxy hexafluoro isopropyl group and application thereof | UNIV EAST CHINA SCIENCE & TECH | 2014-08-20 | — | — | CN | disclosed |
| CN-102320998-A | Phthalic diamide compounds containing 2'-hydroxy hexafluoro isopropyl group and application thereof | UNIV EAST CHINA SCIENCE & TECH | 2012-01-18 | — | — | CN | disclosed |
| EP-1859782-B1 | Composition for coloring and/or lightening human hair comprising tetrazoles | HENKEL AG & CO KGAA (DE) | 2009-12-30 | — | — | EP | disclosed |
| EP-1859782-A1 | Composition for coloring and/or lightening human hair comprising tetrazoles | Henkel Kommanditgesellschaft auf Aktien (DE) | 2007-11-28 | — | — | EP | disclosed |