SCHEMBL17469816

SCHEMBL17469816

CCOC(=O)COS(=O)(=O)O

nearest known ligand 0.48

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
GAA P10253 2/20 0.48
MGAM O43451 1/20 0.48
SI P14410 1/20 0.48
MGAM2 Q2M2H8 1/20 0.48
ALDH1A1 P00352 3/20 0.44
TRPA1 O75762 1/20 0.44
NPSR1 Q6W5P4 1/20 0.44
TSHR P16473 1/20 0.39
CYP1A2 P05177 1/20 0.39
LMNA P02545 1/20 0.39
HSD17B10 Q99714 1/20 0.39
KMT2A Q03164 2/20 0.38
ALOX15 P16050 1/20 0.37
SOAT1 P35610 1/20 0.37
NLRP3 Q96P20 2/20 0.36
POLB P06746 1/20 0.36
CA12 O43570 1/20 0.35
CA1 P00915 1/20 0.35
CA2 P00918 1/20 0.35
CA9 Q16790 1/20 0.35

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
SCHEMBL17469815 0.83 CA1 (0.37) GAAALDH1A1NPSR1TSHRLMNA
SCHEMBL29847028 0.82 GAA (0.48) GAAMGAMSIMGAM2ALDH1A1
SCHEMBL3441164 0.82 GAA (0.48) GAAMGAMSIMGAM2ALDH1A1
SCHEMBL9294344 0.81 ALDH1A1 (0.47) GAAMGAMSIMGAM2ALDH1A1
SCHEMBL17923905 0.80 GAA (0.46) GAAMGAMSIMGAM2ALDH1A1
SCHEMBL27887891 0.80 GAA (0.46) GAAMGAMSIMGAM2ALDH1A1
SCHEMBL17923873 0.80 GAA (0.46) GAAMGAMSIMGAM2ALDH1A1
SCHEMBL17923875 0.79 GAA (0.41) GAAMGAMSIMGAM2ALDH1A1
SCHEMBL9295444 0.79 NAAA (0.47) ALDH1A1NPSR1TSHRKMT2ACA1
SCHEMBL17923906 0.78 GAA (0.40) 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 1 patent. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20160027592-A1 NONAQUEOUS ELECTROLYTE SOLUTION AND ELECTRICITY STORAGE DEVICE USING SAME UBE INDUSTRIES, LTD. (JP) 2016-01-28 US disclosed