SCHEMBL20118273

SCHEMBL20118273

CCc1ccc(-c2ccc(-c3cc(F)c(C(F)(F)Oc4cc(F)c(OC(F)(F)F)c(F)c4)c(F)c3)c(F)c2)cc1

nearest known ligand 0.39

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
GRM2 Q14416 3/20 0.39
ALOX5AP P20292 1/20 0.38
FEN1 P39748 1/20 0.38
FFAR4 Q5NUL3 2/20 0.34
FFAR1 O14842 1/20 0.34
CHRM5 P08912 3/20 0.32
SERPINE1 P05121 1/20 0.31
KIF11 P52732 1/20 0.31
PRMT6 Q96LA8 1/20 0.31
CNR1 P21554 1/20 0.31
CYP17A1 P05093 1/20 0.30
HRH3 Q9Y5N1 1/20 0.30
ERN1 O75460 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
SCHEMBL20118150 0.91 GRM2 (0.36) GRM2ALOX5APFEN1FFAR4FFAR1
SCHEMBL19850723 0.91 GRM2 (0.42) GRM2ALOX5APFEN1FFAR4FFAR1
SCHEMBL16258060 0.90 GRM2 (0.37) GRM2ALOX5APFEN1KIF11
SCHEMBL20118271 0.90 GRM2 (0.37) GRM2ALOX5APFEN1KIF11
SCHEMBL9911959 0.89 GRM2 (0.41) GRM2ALOX5APFEN1FFAR4FFAR1
SCHEMBL19844706 0.88 GRM2 (0.36) GRM2ALOX5APFEN1KIF11
SCHEMBL12625440 0.88 ALOX5AP (0.37) GRM2ALOX5APFEN1KIF11
SCHEMBL12625584 0.88 RARB (0.43) GRM2ALOX5APFEN1FFAR4FFAR1
SCHEMBL12625575 0.87 RARB (0.42) GRM2ALOX5APFEN1FFAR4FFAR1
SCHEMBL20118151 0.87 ALOX5AP (0.37) GRM2ALOX5APFEN1FFAR4FFAR1

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-20180119011-A1 LIQUID CRYSTAL COMPOSITION AND LIQUID CRYSTAL DISPLAY DEVICE THEREOF JIANGSU HECHENG DISPLAY TECHNOLOGY CO., LTD. (CN) 2018-05-03 US disclosed