SCHEMBL12375052

SCHEMBL12375052

C=CC(=O)COc1ccc2cc(-c3ccc(CCC(=O)Oc4ccc(OCOC(=O)C=C)cc4)cc3)ccc2c1

nearest known ligand 0.40

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
THRB P10828 3/20 0.40
PDGFRB P09619 1/20 0.34
PDGFRA P16234 1/20 0.34
FFAR1 O14842 4/20 0.33
KMT2A Q03164 2/20 0.33
AKR1B1 P15121 1/20 0.33
FFAR4 Q5NUL3 1/20 0.33
MAPT P10636 1/20 0.32
HSD17B1 P14061 1/20 0.32
HSD17B2 P37059 1/20 0.32
ADAMTS5 Q9UNA0 1/20 0.32
PDE6D O43924 1/20 0.32
NFKB1 P19838 1/20 0.31
NFKB2 Q00653 1/20 0.31
RELA Q04206 1/20 0.31
HPGD P15428 1/20 0.31
AKR1C3 P42330 1/20 0.30
AKR1C2 P52895 1/20 0.30
PLA2G4A P47712 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
SCHEMBL12375020 0.93 THRB (0.43) THRBFFAR1KMT2AAKR1B1FFAR4
SCHEMBL15582417 0.87 THRB (0.49) THRBFFAR1KMT2AAKR1B1FFAR4
SCHEMBL12154277 0.86 THRB (0.38) THRBFFAR1KMT2AMAPTNFKB1
SCHEMBL12154247 0.85 THRB (0.48) THRBPDGFRBPDGFRAFFAR1KMT2A
SCHEMBL17754262 0.85 THRB (0.39) THRBKMT2AFFAR4MAPTHSD17B1
SCHEMBL12242523 0.85 THRB (0.41) THRBFFAR1KMT2AFFAR4HPGD
SCHEMBL12154226 0.83 THRB (0.52) THRBFFAR1KMT2AFFAR4MAPT
SCHEMBL16425374 0.81 THRB (0.47) THRBFFAR1KMT2AFFAR4MAPT
SCHEMBL13963241 0.81 KMT2A (0.35) THRBKMT2AMAPT
SCHEMBL13963253 0.80 KMT2A (0.36) THRBKMT2AMAPT

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8440101-B2 Liquid crystal composition containing polymerizable compound and liquid crystal display element using the same DIC CORPORATION (JP) 2013-05-14 US disclosed
US-20110186776-A1 LIQUID CRYSTAL COMPOSITION CONTAINING POLYMERIZABLE COMPOUND AND LIQUID CRYSTAL DISPLAY ELEMENT USING THE SAME DIC CORPORATION (JP) 2011-08-04 US disclosed