SCHEMBL7536102

SCHEMBL7536102

CCC(=O)C[S+](C)C(C)(C)C.Cc1ccccc1S(=O)(=O)[O-]

nearest known ligand 0.35

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
HSD11B1 P28845 2/20 0.35
KMT2A Q03164 2/20 0.33
HCRTR2 O43614 1/20 0.33
RAPGEF4 Q8WZA2 1/20 0.33
ABCC9 O60706 1/20 0.33
ABCC8 Q09428 1/20 0.33
KCNJ11 Q14654 1/20 0.33
KCNJ8 Q15842 1/20 0.33
PTPN1 P18031 1/20 0.33
NPSR1 Q6W5P4 3/20 0.32
GAA P10253 2/20 0.32
MAPT P10636 2/20 0.32
L3MBTL1 Q9Y468 2/20 0.32
CA1 P00915 2/20 0.32
CA2 P00918 2/20 0.32
CA9 Q16790 2/20 0.32
CA12 O43570 1/20 0.32
ALDH1A1 P00352 2/20 0.32
ALOX12 P18054 1/20 0.32
HTT P42858 1/20 0.32

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
SCHEMBL7533680 0.90 HSD11B1 (0.33) HSD11B1KMT2AHCRTR2RAPGEF4ABCC9
SCHEMBL7536510 0.86 P2RX7 (0.36) HSD11B1KMT2ANPSR1MAPTL3MBTL1
SCHEMBL6551090 0.81 ALDH1A1 (0.40) KMT2AHCRTR2GAAMAPTL3MBTL1
Alcohol SCHEMBL9198849 0.74 GAA (0.43) HSD11B1KMT2AHCRTR2RAPGEF4NPSR1
SCHEMBL57931 0.72 TDP1 (0.45) HSD11B1KMT2ARAPGEF4GAAMAPT
SCHEMBL16034284 0.72 TDP1 (0.45) HSD11B1KMT2ARAPGEF4GAAMAPT
SCHEMBL5399285 0.72 HSD11B1 (0.42) HSD11B1KMT2ARAPGEF4GAAMAPT
SCHEMBL20658918 0.72 HSD11B1 (0.42) HSD11B1KMT2ARAPGEF4GAAMAPT
SCHEMBL20533883 0.72 HSD11B1 (0.42) HSD11B1KMT2ARAPGEF4GAAMAPT
SCHEMBL8954958 0.72 HSD11B1 (0.42) HSD11B1KMT2ARAPGEF4GAAMAPT

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-20020015913-A1 Chemical amplifying type positive resist composition and sulfonium salt SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 2002-02-07 US disclosed