SCHEMBL6904124

SCHEMBL6904124

COc1ccc(S(=O)(=O)CC(=O)c2ccccc2)cc1

nearest known ligand 0.88

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
HSD11B1 P28845 9/20 0.88
RECQL P46063 2/20 0.69
MEN1 O00255 1/20 0.66
KMT2A Q03164 1/20 0.66
HTT P42858 1/20 0.56
NPSR1 Q6W5P4 1/20 0.56
NPC1 O15118 4/20 0.56
RAB9A P51151 4/20 0.56
ALDH1A1 P00352 3/20 0.56
SMN1; SMN2 Q16637 2/20 0.56
TDP1 Q9NUW8 1/20 0.56
LMNA P02545 1/20 0.54
MAPT P10636 1/20 0.54
L3MBTL1 Q9Y468 1/20 0.54
CES2 O00748 1/20 0.53
CES1 P23141 1/20 0.53

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
SCHEMBL6203408 0.94 HSD11B1 (1.00) HSD11B1RECQLMEN1KMT2ANPC1
SCHEMBL28497899 0.86 HSD11B1 (0.76) HSD11B1RECQLMEN1KMT2AHTT
SCHEMBL29690031 0.84 HSD11B1 (1.00) HSD11B1RECQLMEN1KMT2ANPC1
SCHEMBL28555693 0.84 HSD11B1 (0.84) HSD11B1RECQLMEN1KMT2ANPC1
SCHEMBL452973 0.83 HSD11B1 (0.77) HSD11B1RECQLMEN1KMT2ANPC1
SCHEMBL2422002 0.82 RECQL (1.00) HSD11B1RECQLMEN1KMT2ANPC1
SCHEMBL4592282 0.82 HTT (0.70) HSD11B1MEN1KMT2AHTTNPSR1
SCHEMBL29609513 0.81 HSD11B1 (0.74) HSD11B1RECQLMEN1KMT2ANPC1
SCHEMBL12259460 0.81 HSD11B1 (0.63) HSD11B1RECQLMEN1KMT2AHTT
SCHEMBL29609963 0.81 RECQL (0.97) HSD11B1RECQLMEN1KMT2ANPC1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-111978216-B Preparation method of beta-carbonyl sulfone compound 西南医科大学 2023-02-03 CN disclosed
CN-110981676-B Method for preparing beta-ketosulfone compound through visible light mediated atoxic acid decarboxylation ketonization reaction 西南大学 2022-09-30 CN disclosed
CN-111978216-A Preparation method of beta-carbonyl sulfone compound 西南医科大学 2020-11-24 CN disclosed
CN-110981676-A Method for preparing β -ketosulfone compound through visible light mediated atoxic acid decarboxylation ketonization reaction 西南大学 2020-04-10 CN disclosed
US-6767926-B1 Method for protecting normal cells from cytotoxicity of chemotherapeutic agents TEMPLE UNIVERSITY - OF THE COMMONWEALTH SYSTEM OF HIGHER EDUCATION 2004-07-27 US disclosed