SCHEMBL20202941

SCHEMBL20202941

CCCc1cc(F)c(C(F)(F)Oc2ccc(-c3ccc4c(F)c(F)c(F)cc4c3)cc2)c(F)c1

nearest known ligand 0.36

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
GSK3B P49841 1/20 0.34
CHRNA7 P36544 1/20 0.31
PRMT6 Q96LA8 1/20 0.31
JAK2 O60674 1/20 0.30
ROCK2 O75116 1/20 0.30
PRKD3 O94806 1/20 0.30
PRKCG P05129 1/20 0.30
PHKG2 P15735 1/20 0.30
RPS6KB1 P23443 1/20 0.30
MARK3 P27448 1/20 0.30
PRKCI P41743 1/20 0.30
CLK2 P49760 1/20 0.30
IRAK1 P51617 1/20 0.30
RPS6KA3 P51812 1/20 0.30
PRKCD Q05655 1/20 0.30
MAP4K2 Q12851 1/20 0.30
STK3 Q13188 1/20 0.30
CAMK2B Q13554 1/20 0.30
CAMK2G Q13555 1/20 0.30
CAMK2D Q13557 1/20 0.30

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
SCHEMBL17075778 0.94 ALOX5AP (0.34) GSK3B
SCHEMBL20202935 0.93 GSK3B (0.33) GSK3B
SCHEMBL20202928 0.93 GSK3B (0.33) GSK3BPRMT6
SCHEMBL20202945 0.92 RARB (0.37) GSK3B
SCHEMBL20202931 0.89 ALOX5AP (0.38)
SCHEMBL17083187 0.89 RARB (0.31)
SCHEMBL20202970 0.89 RARB (0.31)
SCHEMBL17083207 0.87 ALOX5AP (0.34)
SCHEMBL7732784 0.86 RARB (0.33) PRMT6
SCHEMBL20202949 0.84 GRM2 (0.33)

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20180148647-A1 COMPOSITION AND LIQUID CRYSTAL DISPLAY USING SAME DIC CORPORATION (JP) 2018-05-31 US disclosed