SCHEMBL28524337

SCHEMBL28524337

COC(=O)c1ccccc1SOSc1ccccc1C(=O)OC

nearest known ligand 0.60

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
HSD17B10 Q99714 2/20 0.60
POLB P06746 2/20 0.60
TSHR P16473 3/20 0.55
LMNA P02545 2/20 0.55
ALDH1A1 P00352 2/20 0.53
CFTR P13569 1/20 0.53
KDM4E B2RXH2 2/20 0.52
ATM Q13315 1/20 0.52
TDP1 Q9NUW8 1/20 0.51
L3MBTL1 Q9Y468 1/20 0.51
MAPT P10636 2/20 0.51
PKLR P30613 1/20 0.49
KMT2A Q03164 2/20 0.47
CA1 P00915 1/20 0.47
CA2 P00918 1/20 0.47
CA5A P35218 1/20 0.47
CA9 Q16790 1/20 0.47
ALOX15 P16050 1/20 0.47
MYC P01106 1/20 0.46
SLC6A3 Q01959 1/20 0.46

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
SCHEMBL4440485 0.84 HSD17B10 (0.64) HSD17B10POLBTSHRLMNAALDH1A1
SCHEMBL30096217 0.84 POLB (0.64) HSD17B10POLBTSHRLMNAALDH1A1
SCHEMBL756511 0.84 POLB (0.64) HSD17B10POLBTSHRLMNAALDH1A1
SCHEMBL7754027 0.82 HSD17B10 (0.62) HSD17B10POLBTSHRLMNAALDH1A1
SCHEMBL647041 0.82 TSHR (0.71) HSD17B10POLBTSHRLMNAALDH1A1
SCHEMBL11121116 0.81 POLB (0.60) HSD17B10POLBTSHRLMNAALDH1A1
SCHEMBL9789934 0.81 HSD17B10 (0.60) HSD17B10POLBTSHRLMNAALDH1A1
SCHEMBL8624849 0.81 HSD17B10 (0.60) HSD17B10POLBTSHRLMNAALDH1A1
SCHEMBL11319693 0.81 POLB (0.60) HSD17B10POLBTSHRLMNAALDH1A1
SCHEMBL11337383 0.81 HSD17B10 (0.60) HSD17B10POLBTSHRLMNAALDH1A1

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
CN-110483349-B Preparation method of alkyl thioether 中国科学院兰州化学物理研究所 2021-01-12 CN disclosed