SCHEMBL6728632

SCHEMBL6728632

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

nearest known ligand 0.43

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 7/20 0.43
MCHR1 Q99705 1/20 0.41
LMNA P02545 2/20 0.39
TDP1 Q9NUW8 2/20 0.39
ALB P02768 1/20 0.39
CYP2C9 P11712 1/20 0.39
TSHR P16473 1/20 0.39
RAB9A P51151 1/20 0.39
KMT2A Q03164 1/20 0.39
PLA2G2C Q5R387 1/20 0.38
HTT P42858 1/20 0.37
L3MBTL1 Q9Y468 2/20 0.37
CA1 P00915 1/20 0.36
CA2 P00918 1/20 0.36
GAA P10253 1/20 0.36
CNR2 P34972 1/20 0.36
STS P08842 3/20 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
SCHEMBL6727480 0.99 ALDH1A1 (0.41) ALDH1A1MCHR1LMNATDP1ALB
SCHEMBL6723266 0.95 ALDH1A1 (0.41) ALDH1A1MCHR1LMNATDP1ALB
SCHEMBL6725988 0.92 ALDH1A1 (0.42) ALDH1A1MCHR1LMNATDP1ALB
SCHEMBL6722944 0.91 ALDH1A1 (0.40) ALDH1A1MCHR1LMNATDP1ALB
SCHEMBL6735007 0.89 ALDH1A1 (0.41) ALDH1A1LMNATDP1ALBCYP2C9
SCHEMBL6727649 0.87 ALDH1A1 (0.39) ALDH1A1MCHR1LMNATDP1ALB
SCHEMBL6734808 0.87 ALDH1A1 (0.43) ALDH1A1MCHR1LMNATDP1ALB
SCHEMBL6734859 0.85 ALDH1A1 (0.41) ALDH1A1MCHR1LMNATDP1ALB
SCHEMBL6728020 0.84 ALDH1A1 (0.39) ALDH1A1MCHR1LMNATDP1ALB
SCHEMBL6728492 0.84 ALDH1A1 (0.41) ALDH1A1MCHR1LMNATDP1ALB

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