SCHEMBL7059943

SCHEMBL7059943

C=C(CC)C(=O)O.C=C(CC=CC(=O)O)C(=O)OC

nearest known ligand 0.34

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
ALOX15 P16050 1/20 0.34
HSD17B10 Q99714 1/20 0.34
HCAR2 Q8TDS4 2/20 0.33
ALDH1A1 P00352 1/20 0.31
GABRR1 P24046 2/20 0.31
GABRR2 P28476 2/20 0.31
BLM P54132 2/20 0.31
GABRR3 A8MPY1 1/20 0.31
LMNA P02545 1/20 0.31
TSHR P16473 1/20 0.31
APEX1 P27695 1/20 0.31
NPSR1 Q6W5P4 1/20 0.31
TDP1 Q9NUW8 1/20 0.31

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
Itaconate SCHEMBL11290333 0.94 ALOX15 (0.45) ALOX15HSD17B10HCAR2
SCHEMBL239948 0.90 HCAR2 (0.40) ALOX15HSD17B10HCAR2ALDH1A1GABRR1
Methacrylic Acid SCHEMBL1219401 0.87 ALDH1A1 (0.42) ALOX15HSD17B10HCAR2ALDH1A1GABRR1
Butadiene SCHEMBL11340927 0.85 HCAR2 (0.36) ALOX15HSD17B10HCAR2ALDH1A1GABRR1
1,1-Dichloroethene SCHEMBL7050642 0.85 HCAR2 (0.36) HCAR2ALDH1A1GABRR1GABRR2BLM
Acrylic Acid SCHEMBL8951871 0.85 ALOX15 (0.41) ALOX15HSD17B10HCAR2ALDH1A1GABRR1
SCHEMBL1473949 0.83 ALDH1A1 (0.52) ALOX15HSD17B10HCAR2ALDH1A1GABRR1
SCHEMBL5857445 0.82 HCAR2 (0.33) HCAR2TSHR
Acrylic Acid Methyl Ester SCHEMBL1474305 0.81 HCAR2 (0.41) ALOX15HSD17B10HCAR2ALDH1A1GABRR1
SCHEMBL5054808 0.80 HCAR2 (0.31) HCAR2

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-6806308-B2 Method for protecting paint on an article, a composition useful therefor, and a method for making the composition CHEMICO SYSTEMS, INC. 2004-10-19 US disclosed
US-20020076487-A1 Method for protecting paint on an article, a composition useful therefor, and a method for making the composition ZAJAC BOHDAN (US) 2002-06-20 US disclosed
US-6391961-B1 Method for protecting paint on article, composition useful therefor, and method for making composition PRODUCT SOL, L.L.C. 2002-05-21 US disclosed
WO-1998055535-A1 METHODS FOR PROTECTING PAINT ON AN ARTICLE, COMPOSITION USEFUL THEREFOR, AND METHOD FOR MAKING THE COMPOSITION PRODUCT SOL, LLC. (US) 1998-12-10 WO disclosed