SCHEMBL12242548

SCHEMBL12242548

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

nearest known ligand 0.38

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
THRB P10828 3/20 0.38
KMT2A Q03164 3/20 0.38
MAPT P10636 2/20 0.36
ACACB O00763 2/20 0.33
MEN1 O00255 1/20 0.33
SLC22A2 O15244 1/20 0.33
TMPRSS2 O15393 1/20 0.33
F2 P00734 1/20 0.33
F10 P00742 1/20 0.33
PLG P00747 1/20 0.33
F12 P00748 1/20 0.33
PLAU P00749 1/20 0.33
PLAT P00750 1/20 0.33
KLKB1 P03952 1/20 0.33
CYP1A2 P05177 1/20 0.33
HPN P05981 1/20 0.33
CHRM2 P08172 1/20 0.33
CYP2D6 P10635 1/20 0.33
SLC6A2 P23975 1/20 0.33
SLC6A3 Q01959 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
SCHEMBL12242523 0.91 THRB (0.41) THRBKMT2AACACBFFAR1FFAR4
SCHEMBL12242534 0.88 FFAR1 (0.37) THRBKMT2AMAPTACACBCYP1A2
SCHEMBL12242532 0.88 FFAR1 (0.40) THRBKMT2AMAPTACACBMEN1
SCHEMBL12242503 0.88 FFAR1 (0.40) THRBKMT2AMAPTACACBMEN1
SCHEMBL12375020 0.83 THRB (0.43) THRBKMT2AMAPTLMNAL3MBTL1
SCHEMBL12242511 0.82 FFAR1 (0.38) THRBKMT2AMAPTACACBCYP1A2
SCHEMBL12242448 0.82 THRB (0.39) THRBKMT2AMAPTMEN1F2
SCHEMBL12242541 0.82 THRB (0.39) THRBKMT2AMAPTMEN1F2
SCHEMBL12242426 0.82 THRB (0.39) THRBKMT2AMAPTMEN1F2
SCHEMBL12242810 0.81 THRB (0.46) THRBKMT2AMAPTMEN1F2

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