SCHEMBL6726082

SCHEMBL6726082

CCC(=O)CS(CC)(CC)OS(=O)(=O)c1ccc(C)cc1

nearest known ligand 0.42

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 5/20 0.42
HSD11B1 P28845 1/20 0.42
KMT2A Q03164 4/20 0.39
GAA P10253 2/20 0.39
RECQL P46063 2/20 0.39
STAT3 P40763 2/20 0.38
HSD17B10 Q99714 2/20 0.37
LMNA P02545 1/20 0.37
SMN1; SMN2 Q16637 1/20 0.37
CYP2D6 P10635 1/20 0.37
G6PD P11413 1/20 0.37
CA2 P00918 1/20 0.36
CA9 Q16790 1/20 0.36
PPARG P37231 1/20 0.36
CTDSP1 Q9GZU7 1/20 0.36
SIRT5 Q9NXA8 1/20 0.36
MEN1 O00255 1/20 0.36
MAPT P10636 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
SCHEMBL6735007 0.88 ALDH1A1 (0.41) ALDH1A1KMT2AGAARECQLSTAT3
SCHEMBL6727540 0.87 ALDH1A1 (0.40) ALDH1A1HSD11B1KMT2AGAARECQL
SCHEMBL6726184 0.86 ALDH1A1 (0.44) ALDH1A1KMT2AGAARECQLSTAT3
SCHEMBL6723266 0.85 ALDH1A1 (0.41) ALDH1A1KMT2AGAARECQLLMNA
SCHEMBL6734452 0.84 ALDH1A1 (0.42) ALDH1A1HSD11B1KMT2AGAARECQL
SCHEMBL6727480 0.84 ALDH1A1 (0.41) ALDH1A1KMT2AGAALMNASMN1; SMN2
SCHEMBL6728632 0.83 ALDH1A1 (0.43) ALDH1A1KMT2AGAALMNACA2
SCHEMBL5412223 0.83 GAA (0.48) ALDH1A1KMT2AGAASMN1; SMN2CYP2D6
SCHEMBL6723573 0.82 ALDH1A1 (0.41) ALDH1A1KMT2AGAARECQLSTAT3
SCHEMBL6726194 0.82 HSD11B1 (0.43) ALDH1A1HSD11B1KMT2AGAARECQL

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-20040224251-A1 Positive resist composition SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 2004-11-11 US disclosed