SCHEMBL8446170

SCHEMBL8446170

CS(=O)(=O)OC(CC(=O)O)Cc1ccc(Cl)cc1

nearest known ligand 0.47

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
KMT2A Q03164 3/20 0.47
MEN1 O00255 2/20 0.47
L3MBTL1 Q9Y468 1/20 0.44
PPARG P37231 5/20 0.43
PPARA Q07869 5/20 0.43
ALDH1A1 P00352 1/20 0.43
MME P08473 1/20 0.42
FDFT1 P37268 1/20 0.41
MAOB P27338 1/20 0.40
FFAR1 O14842 1/20 0.40
GABBR2 O75899 1/20 0.39
LMNA P02545 1/20 0.39
CYP3A4 P08684 1/20 0.39
ADORA3 P0DMS8 1/20 0.39
NFKB1 P19838 1/20 0.39
DRD3 P35462 1/20 0.39
BLM P54132 1/20 0.39
GABBR1 Q9UBS5 1/20 0.39

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
SCHEMBL8447796 0.81 SLC6A2 (0.42) KMT2AMEN1PPARGPPARA
SCHEMBL8447978 0.78 PPARG (0.37) KMT2APPARGPPARAALDH1A1CYP3A4
SCHEMBL11848566 0.78 SLC6A2 (0.48) KMT2AMEN1PPARGPPARAMAOB
SCHEMBL6803189 0.73 ALDH1A1 (0.41) KMT2APPARGPPARAALDH1A1
SCHEMBL27360862 0.73 KDM4E (0.40) KMT2AMEN1
SCHEMBL26210906 0.73 MEN1 (0.51) KMT2AMEN1L3MBTL1PPARGPPARA
SCHEMBL3512373 0.73 MEN1 (0.51) KMT2AMEN1L3MBTL1PPARGPPARA
SCHEMBL17590406 0.73 MEN1 (0.51) KMT2AMEN1L3MBTL1PPARGPPARA
SCHEMBL11460333 0.72 MME (0.51) KMT2AMEN1L3MBTL1PPARGPPARA
SCHEMBL21994674 0.72 MME (0.59) KMT2AMEN1L3MBTL1PPARGPPARA

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
EP-0916654-A1 SULFONIC ESTER DERIVATIVES, PROCESS FOR PREPARING THE SAME, AND USE THEREOF KANEKA CORPORATION (JP) 1999-05-19 EP disclosed