SCHEMBL12375025

SCHEMBL12375025

C=CC(=O)Cc1ccc(-c2ccc(CCC(=O)Oc3ccc(COC(=O)C=C)cc3)cc2)cc1

nearest known ligand 0.45

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
THRB P10828 3/20 0.45
KMT2A Q03164 5/20 0.39
FFAR1 O14842 4/20 0.39
ASAH1 Q13510 1/20 0.36
ENPP2 Q13822 1/20 0.35
HPGD P15428 1/20 0.35
MAPT P10636 2/20 0.34
FFAR4 Q5NUL3 2/20 0.33
ALDH1A1 P00352 1/20 0.33
LMNA P02545 1/20 0.33
HTT P42858 1/20 0.33
HSD17B10 Q99714 1/20 0.33
PDGFRB P09619 1/20 0.32
PDGFRA P16234 1/20 0.32

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
SCHEMBL12242529 0.90 THRB (0.42) THRBKMT2AFFAR1HPGDMAPT
SCHEMBL12375023 0.87 THRB (0.44) THRBKMT2AFFAR1ASAH1HPGD
SCHEMBL12375057 0.87 THRB (0.44) THRBKMT2AFFAR1ASAH1HPGD
SCHEMBL16541707 0.84 THRB (0.46) THRBKMT2AFFAR1HPGDMAPT
SCHEMBL17340246 0.84 THRB (0.62) THRBKMT2AFFAR1ASAH1HPGD
SCHEMBL12375035 0.83 THRB (0.47) THRBKMT2AFFAR1HPGDMAPT
SCHEMBL12375077 0.82 THRB (0.54) THRBKMT2AFFAR1HPGDMAPT
SCHEMBL19769334 0.81 THRB (0.57) THRBKMT2AASAH1LMNAHTT
SCHEMBL690734 0.81 THRB (0.57) THRBKMT2AFFAR1HPGDALDH1A1
SCHEMBL12375024 0.81 THRB (0.43) THRBKMT2AFFAR1MAPTFFAR4

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