SCHEMBL20202910

SCHEMBL20202910

CCc1ccc(-c2ccc(-c3cc(F)c(OC(F)(F)c4cc(F)c(F)c(F)c4)c(F)c3)c(F)c2)cc1

nearest known ligand 0.34

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
RORC P51449 6/20 0.34
AKR1C3 P42330 3/20 0.33
AKR1C2 P52895 3/20 0.33
GRM2 Q14416 2/20 0.33
KIF11 P52732 1/20 0.33
APP P05067 1/20 0.32
CYP17A1 P05093 1/20 0.32
FFAR4 Q5NUL3 2/20 0.31
ALOX5AP P20292 1/20 0.31
FEN1 P39748 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
SCHEMBL17070206 0.91 KIF11 (0.33) KIF11CYP17A1FFAR4
SCHEMBL17402094 0.91 RARB (0.35) RORCAKR1C3AKR1C2KIF11APP
SCHEMBL17402092 0.89 RARB (0.41) RORC
SCHEMBL17402093 0.88 RARB (0.45) RORC
SCHEMBL14827095 0.87 AKR1C3 (0.33) RORCAKR1C3AKR1C2GRM2APP
SCHEMBL9911959 0.84 GRM2 (0.41) RORCGRM2KIF11CYP17A1FFAR4
SCHEMBL30201459 0.83 RARB (0.38) KIF11CYP17A1ALOX5APFEN1
SCHEMBL12850413 0.83 RARB (0.38) KIF11CYP17A1ALOX5APFEN1
SCHEMBL13083533 0.83 RARB (0.38) KIF11CYP17A1ALOX5APFEN1
SCHEMBL18324931 0.82 PTGS2 (0.36) RORCAKR1C3AKR1C2APPALOX5AP

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