SCHEMBL28748804

SCHEMBL28748804

COc1ccc([C@@H](O)CS(=O)(=O)c2ccccc2)cc1

nearest known ligand 0.61

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
HSD11B1 P28845 4/20 0.61
ALDH1A1 P00352 3/20 0.51
SMN1; SMN2 Q16637 3/20 0.51
NPC1 O15118 2/20 0.51
RAB9A P51151 2/20 0.51
TDP1 Q9NUW8 2/20 0.51
MMP13 P45452 3/20 0.50
MMP1 P03956 1/20 0.50
HTT P42858 1/20 0.48
NPSR1 Q6W5P4 1/20 0.48
AOC3 Q16853 2/20 0.46
ACP3 P15309 1/20 0.46
L3MBTL1 Q9Y468 1/20 0.46
EGFR P00533 1/20 0.45
ERBB2 P04626 1/20 0.45
LMNA P02545 1/20 0.44
MAPT P10636 1/20 0.44
KDM4E B2RXH2 1/20 0.44
GAA P10253 1/20 0.44

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
SCHEMBL28397208 1.00 HSD11B1 (0.61) HSD11B1ALDH1A1SMN1; SMN2NPC1RAB9A
SCHEMBL28397210 1.00 HSD11B1 (0.61) HSD11B1ALDH1A1SMN1; SMN2NPC1RAB9A
SCHEMBL12259812 0.92 MMP13 (0.58) HSD11B1MMP13MMP1HTTNPSR1
SCHEMBL28410589 0.87 ALDH1A1 (0.54) HSD11B1ALDH1A1SMN1; SMN2NPC1RAB9A
SCHEMBL12237259 0.87 ALDH1A1 (0.54) HSD11B1ALDH1A1SMN1; SMN2NPC1RAB9A
SCHEMBL28410587 0.87 ALDH1A1 (0.54) HSD11B1ALDH1A1SMN1; SMN2NPC1RAB9A
SCHEMBL12237262 0.85 MMP13 (0.51) HSD11B1ALDH1A1RAB9AMMP13MMP1
SCHEMBL12259813 0.85 GAA (0.52) HSD11B1ALDH1A1MMP13MMP1HTT
SCHEMBL28748875 0.84 L3MBTL1 (0.55) HSD11B1AOC3L3MBTL1
SCHEMBL28748828 0.84 L3MBTL1 (0.55) HSD11B1AOC3L3MBTL1

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 6 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-116769741-B Fusion protein composition and synthesis method of double-enzyme immobilized PHA microsphere and beta-hydroxy sulfone 河北牧群生物科技有限公司 2024-06-18 CN claimed
CN-116769741-A Fusion protein composition and synthesis method of double-enzyme immobilized PHA microsphere and beta-hydroxy sulfone 河北牧群生物科技有限公司 2023-09-19 CN claimed
CN-116769741-B Fusion protein composition and synthesis method of double-enzyme immobilized PHA microsphere and beta-hydroxy sulfone 河北牧群生物科技有限公司 2024-06-18 CN disclosed
CN-114540321-B Preparation method of R-2-sulfonyl-1-phenylethanol derivative 沈阳药科大学 2024-04-02 CN disclosed
CN-116769741-A Fusion protein composition and synthesis method of double-enzyme immobilized PHA microsphere and beta-hydroxy sulfone 河北牧群生物科技有限公司 2023-09-19 CN disclosed
CN-114540321-A Preparation method of R-2-sulfonyl-1-phenylethanol derivative 沈阳药科大学 2022-05-27 CN disclosed