SCHEMBL6723573

SCHEMBL6723573

CCS(CC)(CC(=O)C(C)C)OS(=O)(=O)c1ccc(C)cc1

nearest known ligand 0.41

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 7/20 0.41
KMT2A Q03164 4/20 0.38
GAA P10253 2/20 0.38
MEN1 O00255 1/20 0.37
RECQL P46063 2/20 0.37
CA2 P00918 2/20 0.37
CA9 Q16790 2/20 0.37
CA12 O43570 1/20 0.37
MAPT P10636 1/20 0.37
STAT3 P40763 2/20 0.36
KDM4E B2RXH2 1/20 0.36
HPGD P15428 1/20 0.36
LMNA P02545 1/20 0.35
SMN1; SMN2 Q16637 1/20 0.35
HSD17B10 Q99714 1/20 0.35
CYP2D6 P10635 1/20 0.35
PPARG P37231 1/20 0.35
CTDSP1 Q9GZU7 1/20 0.35
SIRT5 Q9NXA8 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
SCHEMBL6736347 0.88 ALDH1A1 (0.39) ALDH1A1KMT2AGAAMEN1CA2
SCHEMBL6735244 0.84 ALDH1A1 (0.41) ALDH1A1KMT2AGAAMEN1RECQL
SCHEMBL6726184 0.83 ALDH1A1 (0.44) ALDH1A1KMT2AGAAMEN1RECQL
SCHEMBL6731602 0.82 ALDH1A1 (0.41) ALDH1A1KMT2AGAAMEN1RECQL
SCHEMBL6726082 0.82 ALDH1A1 (0.42) ALDH1A1KMT2AGAAMEN1RECQL
SCHEMBL5412223 0.81 GAA (0.48) ALDH1A1KMT2AGAAMEN1CA2
SCHEMBL6726194 0.79 HSD11B1 (0.43) ALDH1A1KMT2AGAAMEN1RECQL
SCHEMBL6735007 0.79 ALDH1A1 (0.41) ALDH1A1KMT2AGAAMEN1RECQL
SCHEMBL6723266 0.77 ALDH1A1 (0.41) ALDH1A1KMT2AGAAMEN1RECQL
SCHEMBL6727480 0.76 ALDH1A1 (0.41) ALDH1A1KMT2AGAAMEN1CA2

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