SCHEMBL12242523

SCHEMBL12242523

C=CC(=O)COc1ccc(C#Cc2ccc(CCC(=O)Oc3ccc(OCOC(=O)C=C)cc3)cc2)cc1

nearest known ligand 0.41

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
THRB P10828 3/20 0.41
KMT2A Q03164 1/20 0.36
ACACB O00763 4/20 0.35
FFAR1 O14842 9/20 0.35
FFAR4 Q5NUL3 1/20 0.35
HPGD P15428 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
SCHEMBL12375020 0.91 THRB (0.43) THRBKMT2AFFAR1FFAR4HPGD
SCHEMBL12242548 0.91 THRB (0.38) THRBKMT2AACACBFFAR1FFAR4
SCHEMBL12154226 0.88 THRB (0.52) THRBKMT2AFFAR1FFAR4HPGD
SCHEMBL12242522 0.86 FFAR1 (0.45) THRBACACBFFAR1HPGD
SCHEMBL12242480 0.86 FFAR1 (0.45) THRBACACBFFAR1HPGD
SCHEMBL12375052 0.85 THRB (0.40) THRBKMT2AFFAR1FFAR4HPGD
SCHEMBL12723893 0.84 THRB (0.45) THRBKMT2AFFAR1FFAR4HPGD
SCHEMBL15582417 0.84 THRB (0.49) THRBKMT2AFFAR1FFAR4HPGD
SCHEMBL12242493 0.83 FFAR1 (0.42) THRBACACBFFAR1HPGD
SCHEMBL12154277 0.83 THRB (0.38) THRBKMT2AFFAR1

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-8460576-B2 Liquid crystal composition containing polymerizable compound and liquid crystal display element using the same DIC CORPORATION (JP) 2013-06-11 US disclosed
US-20110253936-A1 LIQUID CRYSTAL COMPOSITION CONTAINING POLYMERIZABLE COMPOUND AND LIQUID CRYSTAL DISPLAY ELEMENT USING THE SAME DIC CORPORATION (JP) 2011-10-20 US disclosed