SCHEMBL12242556

SCHEMBL12242556

C=CC(=O)Cc1ccc(C#Cc2ccc(-c3ccc(-c4ccc(CCC(=O)OCOC(=O)C=C)cc4)cc3)cc2)cc1

nearest known ligand 0.38

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
FFAR1 O14842 15/20 0.38
FFAR4 Q5NUL3 1/20 0.38
TDP1 Q9NUW8 1/20 0.35
CYP4F2 P78329 1/20 0.35
CYP4A11 Q02928 1/20 0.35
THRB P10828 2/20 0.34

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
SCHEMBL12242558 0.83 CA12 (0.39) FFAR1
SCHEMBL12242502 0.83 FFAR1 (0.39) FFAR1FFAR4THRB
SCHEMBL12242529 0.81 THRB (0.42) FFAR1FFAR4THRB
SCHEMBL12242546 0.79 FFAR1 (0.39) FFAR1FFAR4THRB
SCHEMBL12242527 0.79 FFAR1 (0.41) FFAR1FFAR4THRB
SCHEMBL12242484 0.79 FFAR1 (0.41) FFAR1FFAR4THRB
SCHEMBL12375025 0.77 THRB (0.45) FFAR1FFAR4THRB
SCHEMBL12242523 0.76 THRB (0.41) FFAR1FFAR4THRB
SCHEMBL19759238 0.76 THRB (0.36) FFAR1THRB
SCHEMBL12242448 0.75 THRB (0.39) FFAR1FFAR4THRB

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