SCHEMBL4408385

SCHEMBL4408385

CC(C)Cc1nnnn1C(F)(F)F

nearest known ligand 0.33

Predicted protein targets (top 1)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 2/20 0.33

Click a target to see other patent compounds predicted against it — the reverse direction, in place.

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.

Compoundsimilaritytop predictedshared targets
SCHEMBL4407839 0.85 ALDH1A1 (0.32) ALDH1A1
SCHEMBL4405753 0.82 ALDH1A1 (0.49) ALDH1A1
SCHEMBL4408120 0.81 ALDH1A1 (0.33) ALDH1A1
SCHEMBL4408268 0.78 ALDH1A1 (0.32) ALDH1A1
SCHEMBL4408149 0.78 ALDH1A1 (0.40) ALDH1A1
SCHEMBL4403762 0.74 ALDH1A1 (0.38) ALDH1A1
SCHEMBL4412052 0.74 ALDH1A1 (0.38) ALDH1A1
SCHEMBL4407893 0.74 CNR2 (0.32) ALDH1A1
SCHEMBL4412051 0.72 ALDH1A1 (0.38) ALDH1A1
SCHEMBL4411241 0.71 ALDH1A1 (0.39) ALDH1A1

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 2 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
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