SCHEMBL12375034

SCHEMBL12375034

C=C(C)C(=O)COc1ccc(CCC(=O)Oc2ccc(OCOC(=O)C(=C)C)cc2)cc1

nearest known ligand 0.44

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
KMT2A Q03164 3/20 0.44
HTT P42858 2/20 0.38
POLB P06746 1/20 0.38
APEX1 P27695 1/20 0.38
TDP1 Q9NUW8 1/20 0.38
LMNA P02545 4/20 0.36
L3MBTL1 Q9Y468 2/20 0.36
GAA P10253 1/20 0.36
MAPT P10636 2/20 0.36
ALDH1A1 P00352 1/20 0.35
HSD17B10 Q99714 1/20 0.35
CYP4F2 P78329 1/20 0.35
CYP4A11 Q02928 1/20 0.35
FFAR1 O14842 1/20 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
SCHEMBL12375021 0.97 KMT2A (0.42) KMT2AHTTPOLBAPEX1TDP1
SCHEMBL12375044 0.92 MAPT (0.41) KMT2AHTTPOLBAPEX1TDP1
SCHEMBL12375054 0.90 KMT2A (0.37) KMT2AHTTPOLBAPEX1TDP1
SCHEMBL12375048 0.89 MAPT (0.37) KMT2AHTTPOLBAPEX1TDP1
SCHEMBL11986159 0.87 KMT2A (0.43) KMT2AHTTPOLBAPEX1TDP1
SCHEMBL16425368 0.85 KMT2A (0.43) KMT2AHTTPOLBAPEX1TDP1
SCHEMBL16425296 0.82 MAPT (0.43) KMT2APOLBMAPTALDH1A1FFAR1
SCHEMBL11986141 0.82 KMT2A (0.41) KMT2AHTTPOLBAPEX1TDP1
SCHEMBL13289737 0.81 KMT2A (0.40) KMT2AHTTPOLBAPEX1TDP1
SCHEMBL12375059 0.81 MAPT (0.48) KMT2AHTTPOLBAPEX1TDP1

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-8440101-B2 Liquid crystal composition containing polymerizable compound and liquid crystal display element using the same DIC CORPORATION (JP) 2013-05-14 US disclosed
US-20110186776-A1 LIQUID CRYSTAL COMPOSITION CONTAINING POLYMERIZABLE COMPOUND AND LIQUID CRYSTAL DISPLAY ELEMENT USING THE SAME DIC CORPORATION (JP) 2011-08-04 US disclosed