SCHEMBL12375024

SCHEMBL12375024

C=CC(=O)OCc1ccc(OC(=O)CCc2ccc(-c3ccc(OCC(=O)C(=C)C)cc3)cc2)cc1

nearest known ligand 0.43

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
THRB P10828 3/20 0.43
FFAR1 O14842 6/20 0.40
KMT2A Q03164 3/20 0.40
FFAR4 Q5NUL3 2/20 0.34
MAPT P10636 1/20 0.33
MEN1 O00255 1/20 0.33
GAA P10253 1/20 0.33
AKR1C3 P42330 1/20 0.33

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
SCHEMBL12375057 0.90 THRB (0.44) THRBFFAR1KMT2AMAPTMEN1
SCHEMBL12375023 0.90 THRB (0.44) THRBFFAR1KMT2AMAPTMEN1
SCHEMBL16541707 0.87 THRB (0.46) THRBFFAR1KMT2AMAPT
SCHEMBL12375035 0.86 THRB (0.47) THRBFFAR1KMT2AMAPT
SCHEMBL12375053 0.85 THRB (0.43) THRBFFAR1KMT2AFFAR4MAPT
SCHEMBL12375055 0.84 FFAR1 (0.40) THRBFFAR1KMT2AFFAR4MEN1
SCHEMBL12375029 0.84 FFAR1 (0.40) THRBFFAR1KMT2AFFAR4MEN1
SCHEMBL12375061 0.83 MAPT (0.46) THRBFFAR1KMT2AMAPTMEN1
SCHEMBL12375021 0.82 KMT2A (0.42) FFAR1KMT2AMAPTGAA
SCHEMBL12375025 0.81 THRB (0.45) THRBFFAR1KMT2AFFAR4MAPT

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