SCHEMBL713413

SCHEMBL713413

CC(=O)OCc1ccc(-c2ccc(O)cc2)cc1

nearest known ligand 0.62

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 1/20 0.62
MEN1 O00255 1/20 0.55
KMT2A Q03164 1/20 0.55
HSD17B1 P14061 2/20 0.50
CYP3A4 P08684 1/20 0.49
PREP P48147 3/20 0.46
LMNA P02545 2/20 0.46
CELA1 Q9UNI1 1/20 0.46
NPC1 O15118 1/20 0.45
RAB9A P51151 1/20 0.45
HDAC2 Q92769 1/20 0.44
HDAC8 Q9BY41 1/20 0.44
ESR1 P03372 1/20 0.44
ESR2 Q92731 1/20 0.44
IDO1 P14902 1/20 0.43
KDM4E B2RXH2 1/20 0.43

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
SCHEMBL126492 0.94 ALDH1A1 (0.69) ALDH1A1MEN1KMT2ACYP3A4LMNA
SCHEMBL4198688 0.94 ALDH1A1 (0.69) ALDH1A1MEN1KMT2ACYP3A4NPC1
SCHEMBL132773 0.87 ALDH1A1 (0.78) ALDH1A1MEN1KMT2ACYP3A4LMNA
SCHEMBL9686517 0.86 ALDH1A1 (0.60) ALDH1A1CYP3A4LMNANPC1RAB9A
SCHEMBL487227 0.86 ALDH1A1 (0.78) ALDH1A1KMT2ALMNANPC1RAB9A
SCHEMBL9687590 0.86 ALDH1A1 (0.60) ALDH1A1CYP3A4LMNANPC1RAB9A
SCHEMBL12518683 0.86 ALDH1A1 (0.60) ALDH1A1MEN1KMT2ACYP3A4LMNA
SCHEMBL13754587 0.85 ALDH1A1 (0.58) ALDH1A1MEN1KMT2ACYP3A4LMNA
SCHEMBL19721780 0.83 ALDH1A1 (0.56) ALDH1A1NPC1RAB9AESR2IDO1
SCHEMBL28341614 0.83 ALDH1A1 (0.56) ALDH1A1MEN1KMT2ACYP3A4NPC1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1945737-B1 COPOLYMER FOR LIQUID CRYSTAL ALIGNMENT, LIQUID CRYSTAL ALIGNING LAYER INCLUDING COPOLYMER FOR LIQUID CRYSTAL ALIGNMENT, AND LIQUID CRYSTAL DISPLAY INCLUDING LIQUID CRYSTAL ALIGNING LAYER LG CHEMICAL LTD (KR) 2013-03-06 EP disclosed
US-8123977-B2 Copolymer for liquid crystal alignment, liquid crystal aligning layer including copolymer for liquid crystal alignment, and liquid crystal display including liquid crystal aligning layer LG CHEM, LTD. (KR) 2012-02-28 US disclosed
EP-1945737-A1 COPOLYMER FOR LIQUID CRYSTAL ALIGNMENT, LIQUID CRYSTAL ALIGNING LAYER INCLUDING COPOLYMER FOR LIQUID CRYSTAL ALIGNMENT, AND LIQUID CRYSTAL DISPLAY INCLUDING LIQUID CRYSTAL ALIGNING LAYER LG Chem, Ltd. (KR) 2008-07-23 EP disclosed
WO-2007052979-A1 COPOLYMER FOR LIQUID CRYSTAL ALIGNMENT, LIQUID CRYSTAL ALIGNING LAYER INCLUDING COPOLYMER FOR LIQUID CRYSTAL ALIGNMENT, AND LIQUID CRYSTAL DISPLAY INCLUDING LIQUID CRYSTAL ALIGNING LAYER LG CHEM. LTD. (KR) 2007-05-10 WO disclosed
US-20070102668-A1 Copolymer for liquid crystal alignment , liquid crystal aligning layer including copolymer for liquid crystal alignment, and liquid crystal display including liquid crystal aligning layer LG CHEM, LTD. (KR) 2007-05-10 US disclosed