SCHEMBL20202958

SCHEMBL20202958

CCCCc1ccc(-c2cc(F)c(OCc3ccc4c(F)c(F)c(F)cc4c3)c(F)c2)c(F)c1

nearest known ligand 0.35

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
RARB P10826 3/20 0.35
PSMB5 P28074 1/20 0.32
FFAR4 Q5NUL3 1/20 0.32
GRM2 Q14416 1/20 0.32
MPL P40238 2/20 0.31
RARA P10276 1/20 0.30
RARG P13631 1/20 0.30
HDAC1 Q13547 2/20 0.30
HDAC6 Q9UBN7 2/20 0.30
HDAC5 Q9UQL6 2/20 0.30
HDAC8 Q9BY41 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
SCHEMBL20202955 0.97 RARB (0.39) RARBFFAR4GRM2RARARARG
SCHEMBL20202964 0.94 RARB (0.38) RARBMPLRARARARG
SCHEMBL20202950 0.94 FFAR4 (0.32) FFAR4GRM2HDAC1HDAC6HDAC5
SCHEMBL20202940 0.93 RARB (0.38) RARBFFAR4MPL
SCHEMBL20202961 0.91 RARB (0.42) RARBMPLRARARARG
SCHEMBL20202954 0.90 KDM1A (0.35) FFAR4HDAC1HDAC6HDAC5HDAC8
SCHEMBL20202930 0.89 RARB (0.42) RARBFFAR4MPLRARARARG
SCHEMBL20202953 0.88 RARB (0.39) RARBFFAR4MPLRARARARG
SCHEMBL20202942 0.88 RARB (0.39) RARBFFAR4MPLRARARARG
SCHEMBL20202957 0.87 RARB (0.33) RARBFFAR4MPLRARARARG

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