SCHEMBL4404895

SCHEMBL4404895

CCCCc1nnn(C(F)(F)C(F)(F)F)n1

nearest known ligand 0.31

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
GABRA2 P47869 1/20 0.31
GABRB2 P47870 1/20 0.31
DDX3X O00571 1/20 0.31

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
SCHEMBL4411049 0.95 GPR84 (0.33) GABRA2GABRB2DDX3X
SCHEMBL4411186 0.93 GABRA2 (0.34) GABRA2GABRB2DDX3X
SCHEMBL4405112 0.89
SCHEMBL4406930 0.86 GABRA2 (0.33) GABRA2GABRB2
SCHEMBL4407681 0.82
SCHEMBL4409256 0.81 GABRA2 (0.34) GABRA2GABRB2DDX3X
SCHEMBL4409173 0.80 TSHR (0.33)
SCHEMBL4408964 0.79 GABRA2 (0.35) GABRA2GABRB2DDX3X
SCHEMBL4405651 0.79 GABRA2 (0.30) GABRA2GABRB2
SCHEMBL4408208 0.76 GGPS1 (0.31)

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