SCHEMBL14614229

SCHEMBL14614229

CCOC(=O)CC(C)(CC)CC(C)(C)CC

nearest known ligand 0.41

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
GAA P10253 2/20 0.41
MGAM O43451 1/20 0.41
SI P14410 1/20 0.41
MGAM2 Q2M2H8 1/20 0.41
ALDH1A1 P00352 3/20 0.39
TRPA1 O75762 1/20 0.39
HSD11B1 P28845 1/20 0.35
CYP1A2 P05177 1/20 0.34
GSK3A P49840 1/20 0.34
GSK3B P49841 1/20 0.34
LMNA P02545 1/20 0.33
HSD17B10 Q99714 1/20 0.33
ALOX15 P16050 1/20 0.32
SOAT1 P35610 1/20 0.32
CA12 O43570 1/20 0.32
CA1 P00915 1/20 0.32
CA2 P00918 1/20 0.32
CA9 Q16790 1/20 0.32
CYP4F2 P78329 2/20 0.31
CYP4A11 Q02928 2/20 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
SCHEMBL5973054 0.86 GAA (0.50) GAAMGAMSIMGAM2ALDH1A1
SCHEMBL10447420 0.81 GAA (0.50) GAAMGAMSIMGAM2ALDH1A1
SCHEMBL13865867 0.78 GAA (0.43) GAAMGAMSIMGAM2ALDH1A1
SCHEMBL232993 0.77 GAA (0.55) GAAMGAMSIMGAM2ALDH1A1
SCHEMBL12855109 0.76 GAA (0.40) GAAMGAMSIMGAM2ALDH1A1
SCHEMBL8066490 0.74 ALDH1A1 (0.45) GAAMGAMSIMGAM2ALDH1A1
SCHEMBL12697414 0.74 ALDH1A1 (0.39) GAAMGAMSIMGAM2ALDH1A1
SCHEMBL13251257 0.74 GAA (0.46) GAAMGAMSIMGAM2ALDH1A1
SCHEMBL14727725 0.74 LMNA (0.48) GAAMGAMSIMGAM2ALDH1A1
SCHEMBL14156993 0.73 LMNA (0.38) GAAMGAMSIMGAM2ALDH1A1

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
EP-1752479-B1 ACRYLIC STAR POLYMER NIPPON SODA CO (JP) 2013-02-27 EP disclosed
EP-1752479-A1 ACRYLIC STAR POLYMER NIPPON SODA CO., LTD. (JP) 2007-02-14 EP disclosed