SCHEMBL28543766

SCHEMBL28543766

Cc1cc(O)ccc1NS(=O)(=O)O

nearest known ligand 0.63

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CYTH2 Q99418 5/20 0.63
GAA P10253 7/20 0.44
ALDH1A1 P00352 5/20 0.44
LMNA P02545 3/20 0.44
KDM4E B2RXH2 2/20 0.44
MAPT P10636 2/20 0.44
ALOX15 P16050 1/20 0.44
CASP1 P29466 1/20 0.44
CASP7 P55210 1/20 0.44
RUNX1 Q01196 1/20 0.44
CBFB Q13951 1/20 0.44
HSD17B10 Q99714 1/20 0.44
KMT2A Q03164 3/20 0.43
PKM P14618 1/20 0.43
HTT P42858 2/20 0.42
MEN1 O00255 2/20 0.42
HPGD P15428 1/20 0.42
GFER P55789 3/20 0.41
TSHR P16473 3/20 0.41
SMN1; SMN2 Q16637 1/20 0.41

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
SCHEMBL1128401 0.85 CYTH2 (0.63) CYTH2GAAALDH1A1LMNAKDM4E
SCHEMBL11672576 0.82 FKBP1A (0.54) CYTH2ALDH1A1MAPTKMT2APKM
SCHEMBL11311081 0.81 CYTH2 (0.42) CYTH2GAAALDH1A1LMNAKDM4E
SCHEMBL9157782 0.80 ERBB2 (0.41) CYTH2ALDH1A1LMNAALOX15CASP1
SCHEMBL28797214 0.79 MAPT (0.49) CYTH2GAAALDH1A1KDM4EMAPT
SCHEMBL7178299 0.78 CYTH2 (0.73) CYTH2GAAALDH1A1LMNAMAPT
SCHEMBL28805203 0.77 L3MBTL1 (0.55) GAAALDH1A1LMNAKDM4EMAPT
SCHEMBL27515712 0.77 PTGS1 (0.43) CYTH2GAAALDH1A1LMNAMAPT
SCHEMBL7644039 0.74 GAA (0.61) CYTH2GAAALDH1A1LMNAKDM4E
SCHEMBL2004599 0.74 ALDH1A1 (0.53) GAAALDH1A1KDM4EMAPTHTT

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-112526032-B Method for detecting policresulen 北京金城泰尔制药有限公司 2022-05-17 CN disclosed
CN-112526032-A Method for detecting policresulen 北京金城泰尔制药有限公司 2021-03-19 CN disclosed