SCHEMBL13796233

SCHEMBL13796233

C=C(C)C(=O)CC(O)COc1ccc(C(C)(C)c2ccc(OCC(O)COC(=O)C(=C)C)cc2)cc1

nearest known ligand 0.86

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
HTT P42858 3/20 0.47
HIF1A Q16665 1/20 0.47
AR P10275 2/20 0.46
POLB P06746 3/20 0.44
MAPT P10636 3/20 0.44
LMNA P02545 2/20 0.44
NPSR1 Q6W5P4 2/20 0.44
KMT2A Q03164 4/20 0.41
MEN1 O00255 3/20 0.41
ALDH1A1 P00352 3/20 0.41
KDM4E B2RXH2 2/20 0.41
SMN1; SMN2 Q16637 2/20 0.40
CYP1A2 P05177 1/20 0.40
APEX1 P27695 1/20 0.38
TDP1 Q9NUW8 1/20 0.38
HSD17B10 Q99714 1/20 0.37
MITF O75030 1/20 0.37
MAPK1 P28482 1/20 0.37
TSHR P16473 1/20 0.36
USP2 O75604 1/20 0.36

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
SCHEMBL20610370 0.93 HTT (0.53) HTTHIF1AARPOLBMAPT
SCHEMBL15349 0.93 HTT (0.53) HTTHIF1AARPOLBMAPT
SCHEMBL22020008 0.93 HTT (0.53) HTTHIF1AARPOLBMAPT
SCHEMBL14173202 0.93 HTT (0.53) HTTHIF1AARPOLBMAPT
SCHEMBL11967041 0.93 HTT (0.53) HTTHIF1AARPOLBMAPT
SCHEMBL244204 0.92 HTT (0.55) HTTHIF1AARPOLBMAPT
Bicarbonate SCHEMBL7732697 0.90 HTT (0.51) HTTHIF1AARPOLBMAPT
SCHEMBL15803522 0.89 HTT (0.50) HTTHIF1AARPOLBMAPT
SCHEMBL19479960 0.89 AR (0.54) HTTHIF1AARPOLBMAPT
Methacrylic Acid SCHEMBL14881206 0.89 HTT (0.50) HTTHIF1AARPOLBMAPT

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-9644123-B2 Isocyanurate vinyl ester anchoring adhesive composition ILLINOIS TOOL WORKS INC. (US) 2017-05-09 US disclosed
US-9074114-B2 Isocyanurate vinyl ester anchoring adhesive composition ILLINOIS TOOL WORKS INC. (US) 2015-07-07 US disclosed
US-20120296038-A1 ISOCYANURATE VINYL ESTER ANCHORING ADHESIVE COMPOSITION ILLINOIS TOOL WORKS INC. (US) 2012-11-22 US disclosed
US-7544739-B2 Curable adhesive compositions containing reactive multi-functional acrylate ILLINOIS TOOL WORKS INC. (US) 2009-06-09 US disclosed