SCHEMBL12242566

SCHEMBL12242566

C=CC(=O)COc1ccc(C#Cc2ccc(OCOC(=O)C=C)c(OCOC(=O)C=C)c2)cc1

nearest known ligand 0.39

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
FFAR1 O14842 4/20 0.39
THRB P10828 1/20 0.37
ACACB O00763 7/20 0.35
PTGDR2 Q9Y5Y4 2/20 0.33
ACHE P22303 1/20 0.32
MAPT P10636 1/20 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
SCHEMBL12242483 0.94 FFAR1 (0.39) FFAR1THRBACACBACHEMAPT
SCHEMBL12242482 0.90 FFAR1 (0.37) FFAR1THRBACACBPTGDR2ACHE
SCHEMBL12242480 0.89 FFAR1 (0.45) FFAR1THRBACACB
SCHEMBL12242522 0.89 FFAR1 (0.45) FFAR1THRBACACB
SCHEMBL19759397 0.89 THRB (0.42) FFAR1THRBACACBPTGDR2
SCHEMBL19759244 0.87 THRB (0.33) FFAR1THRB
SCHEMBL12242488 0.86 FFAR1 (0.39) FFAR1THRBACACB
SCHEMBL12242493 0.85 FFAR1 (0.42) FFAR1THRBACACBMAPT
SCHEMBL12242514 0.85 ACHE (0.38) ACHEMAPT
SCHEMBL12242499 0.84 PTGDR2 (0.37) FFAR1THRBACACBPTGDR2ACHE

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