SCHEMBL12242546

SCHEMBL12242546

C=CC(=O)COc1ccc(C#Cc2ccc(-c3ccc(CCC(=O)OCOC(=O)C=C)cc3)cc2F)cc1

nearest known ligand 0.39

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
FFAR1 O14842 17/20 0.39
FFAR4 Q5NUL3 2/20 0.39
ACACB O00763 1/20 0.31
AKR1B1 P15121 1/20 0.31
THRB P10828 2/20 0.31

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
SCHEMBL12242524 0.82 FFAR1 (0.36) FFAR1FFAR4ACACBTHRB
SCHEMBL12242523 0.79 THRB (0.41) FFAR1FFAR4ACACBTHRB
SCHEMBL12242556 0.79 FFAR1 (0.38) FFAR1FFAR4THRB
SCHEMBL12242495 0.78 FFAR1 (0.34) FFAR1ACACBTHRB
SCHEMBL12242493 0.77 FFAR1 (0.42) FFAR1ACACBTHRB
SCHEMBL12242548 0.77 THRB (0.38) FFAR1FFAR4ACACBTHRB
SCHEMBL12375020 0.77 THRB (0.43) FFAR1FFAR4AKR1B1THRB
SCHEMBL12242557 0.76 FFAR1 (0.35) FFAR1FFAR4ACACB
SCHEMBL12242407 0.75 THRB (0.34) THRB
SCHEMBL12375052 0.75 THRB (0.40) FFAR1FFAR4AKR1B1THRB

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