SCHEMBL688959

SCHEMBL688959

C=C(C)C(=O)OCCCOc1ccc2cc(OC(=O)C(=C)C)ccc2c1

nearest known ligand 0.57

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
POLB P06746 1/20 0.57
APEX1 P27695 1/20 0.57
HTT P42858 1/20 0.57
TDP1 Q9NUW8 1/20 0.57
TSHR P16473 2/20 0.44
ELANE P08246 1/20 0.42
PDE3B Q13370 2/20 0.42
PDE3A Q14432 2/20 0.42
P2RY12 Q9H244 2/20 0.42
KMT2A Q03164 1/20 0.40
ATM Q13315 1/20 0.40
MTNR1A P48039 1/20 0.39
MTNR1B P49286 1/20 0.39
KDM4E B2RXH2 1/20 0.39
ALDH1A1 P00352 1/20 0.39
L3MBTL1 Q9Y468 1/20 0.38
THRB P10828 1/20 0.38
HDAC1 Q13547 1/20 0.38
PPARD Q03181 2/20 0.38
PPARG P37231 1/20 0.38

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
SCHEMBL15301825 0.94 POLB (0.62) POLBAPEX1HTTTDP1TSHR
SCHEMBL15302794 0.91 POLB (0.59) POLBAPEX1HTTTDP1TSHR
SCHEMBL17081954 0.91 TDP1 (0.59) POLBAPEX1HTTTDP1TSHR
SCHEMBL15302403 0.91 POLB (0.67) POLBAPEX1HTTTDP1TSHR
SCHEMBL16541364 0.90 TDP1 (0.49) POLBAPEX1HTTTDP1TSHR
SCHEMBL16921466 0.90 HTT (0.69) POLBAPEX1HTTTDP1TSHR
SCHEMBL15302790 0.88 POLB (0.63) POLBAPEX1HTTTDP1TSHR
SCHEMBL690787 0.88 HTT (0.67) POLBAPEX1HTTTDP1TSHR
SCHEMBL15303149 0.86 TDP1 (0.56) POLBAPEX1HTTTDP1TSHR
SCHEMBL378966 0.85 POLB (0.50) POLBAPEX1HTTTDP1TSHR

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 11 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8304035-B2 Liquid crystal display MERCK PATENT GMBH (DE) 2012-11-06 US disclosed
US-8304035-B2 Liquid crystal display MERCK PATENT GMBH (DE) 2012-11-06 US disclosed
US-8304035-B2 Liquid crystal display MERCK PATENT GMBH (DE) 2012-11-06 US disclosed
EP-2181173-B1 LIQUID CRYSTAL DISPLAY MERCK PATENT GMBH (DE) 2012-02-29 EP disclosed
EP-2181173-B1 LIQUID CRYSTAL DISPLAY MERCK PATENT GMBH (DE) 2012-02-29 EP disclosed
US-20100309423-A1 Liquid Crystal Display MERCK PATENT GESELLSCHAFT (DE) 2010-12-09 US disclosed
US-20100309423-A1 Liquid Crystal Display MERCK PATENT GESELLSCHAFT (DE) 2010-12-09 US disclosed
US-20100309423-A1 Liquid Crystal Display MERCK PATENT GESELLSCHAFT (DE) 2010-12-09 US disclosed
EP-2181173-A1 LIQUID CRYSTAL DISPLAY Merck Patent GmbH (DE) 2010-05-05 EP disclosed
WO-2009030329-A1 LIQUID CRYSTAL DISPLAY MERCK PATENT GMBH (DE) 2009-03-12 WO disclosed
WO-2009030329-A1 LIQUID CRYSTAL DISPLAY MERCK PATENT GMBH (DE) 2009-03-12 WO disclosed