SCHEMBL15906276

SCHEMBL15906276

C=CC(=O)CCc1ccc(-c2ccc(OC(=O)C=C)cc2)cc1

nearest known ligand 0.62

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
THRB P10828 4/20 0.62
FFAR1 O14842 7/20 0.42
PDE6D O43924 1/20 0.41
NFKB1 P19838 1/20 0.39
NFKB2 Q00653 1/20 0.39
RELA Q04206 1/20 0.39
F2RL1 P55085 1/20 0.38
HDAC2 Q92769 1/20 0.37
HDAC8 Q9BY41 1/20 0.37
MMP12 P39900 1/20 0.37
ALDH1A1 P00352 1/20 0.37
KMT2A Q03164 1/20 0.36
FFAR4 Q5NUL3 2/20 0.36
AKR1B1 P15121 1/20 0.36
LMNA P02545 1/20 0.36
L3MBTL1 Q9Y468 1/20 0.36

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
SCHEMBL22566602 0.89 THRB (0.72) THRBFFAR1PDE6DNFKB1NFKB2
SCHEMBL22566502 0.89 THRB (0.72) THRBFFAR1PDE6DNFKB1NFKB2
SCHEMBL17340246 0.88 THRB (0.62) THRBFFAR1PDE6DNFKB1NFKB2
SCHEMBL17897411 0.87 FFAR1 (0.52) THRBFFAR1HDAC2HDAC8MMP12
SCHEMBL19456765 0.85 THRB (0.77) THRBFFAR1PDE6DHDAC2ALDH1A1
SCHEMBL19769334 0.84 THRB (0.57) THRBPDE6DKMT2ALMNA
SCHEMBL242424 0.83 THRB (0.78) THRBFFAR1PDE6DKMT2A
SCHEMBL17791334 0.83 THRB (0.79) THRBFFAR1PDE6DNFKB1NFKB2
SCHEMBL15906277 0.83 THRB (0.47) THRBFFAR1FFAR4
SCHEMBL815739 0.83 THRB (0.90) THRBPDE6DALDH1A1KMT2A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20160244669-A1 COMPOSITION AND LIQUID CRYSTAL DISPLAY ELEMENT USING SAME DIC CORPORATION (JP) 2016-08-25 US disclosed
US-20160230093-A1 COMPOSITION AND LIQUID CRYSTAL DISPLAY ELEMENT USING SAME DIC CORPORATION (JP) 2016-08-11 US disclosed
EP-2759869-A1 LCD DEVICE DIC Corporation (JP) 2014-07-30 EP disclosed