SCHEMBL20202930

SCHEMBL20202930

CCCCCc1cc(F)c(OCc2ccc(-c3ccc4c(F)c(F)c(F)cc4c3)c(F)c2)c(F)c1

nearest known ligand 0.42

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
RARB P10826 4/20 0.42
FFAR4 Q5NUL3 4/20 0.35
RARA P10276 1/20 0.34
RARG P13631 1/20 0.34
PTGS2 P35354 2/20 0.32
FAAH O00519 1/20 0.32
HSD17B1 P14061 1/20 0.32
HSD17B2 P37059 1/20 0.32
S1PR1 P21453 2/20 0.32
S1PR3 Q99500 2/20 0.32
MAPT P10636 2/20 0.31
RAB9A P51151 2/20 0.31
NPC1 O15118 1/20 0.31
STAT3 P40763 1/20 0.31
ATM Q13315 1/20 0.31
SMN1; SMN2 Q16637 1/20 0.31
ESR1 P03372 2/20 0.31
ESR2 Q92731 2/20 0.31
CYP3A4 P08684 1/20 0.31
L3MBTL1 Q9Y468 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
SCHEMBL20202940 0.97 RARB (0.38) RARBFFAR4PTGS2FAAHHSD17B1
SCHEMBL20202955 0.93 RARB (0.39) RARBFFAR4RARARARGPTGS2
SCHEMBL20202927 0.92 FFAR4 (0.37) RARBFFAR4HSD17B1HSD17B2RAB9A
SCHEMBL20202961 0.91 RARB (0.42) RARBRARARARGS1PR1S1PR3
SCHEMBL20202929 0.90 RARB (0.41) RARBFFAR4RARARARGPTGS2
SCHEMBL15088627 0.90 FFAR4 (0.36) FFAR4HSD17B1HSD17B2ESR1ESR2
SCHEMBL20202958 0.89 RARB (0.35) RARBFFAR4RARARARGMPL
SCHEMBL20202924 0.89 RARB (0.48) RARBRARARARGPTGS2FAAH
SCHEMBL19082932 0.88 RARB (0.46) RARBFFAR4RARARARGPTGS2
SCHEMBL20202964 0.88 RARB (0.38) RARBRARARARGS1PR1S1PR3

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