SCHEMBL788101

SCHEMBL788101

Cc1cccc2sc(S(=O)(=O)Cl)c(C)c12

nearest known ligand 0.40

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
PKM P14618 1/20 0.33
KEAP1 Q14145 1/20 0.33
NFE2L2 Q16236 1/20 0.33
ALDH1A1 P00352 2/20 0.32
MEN1 O00255 1/20 0.32
POLB P06746 1/20 0.32
GAA P10253 1/20 0.32
MAPT P10636 1/20 0.32
KMT2A Q03164 1/20 0.32
SLC9A1 P19634 2/20 0.31

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
SCHEMBL3690288 0.85 MCL1 (0.41) ALDH1A1MEN1MAPTKMT2ASLC9A1
SCHEMBL787663 0.75 HSD11B1 (0.43) ALDH1A1MEN1POLBGAAMAPT
SCHEMBL2387694 0.71 ALDH1A1 (0.38) ALDH1A1MEN1POLBGAAMAPT
SCHEMBL4160530 0.70 ALDH1A1 (0.43) ALDH1A1MEN1POLBGAAMAPT
SCHEMBL1260293 0.69 CA2 (0.42) MAPTSLC9A1
SCHEMBL27850397 0.68 ALDH1A1 (0.36) ALDH1A1
SCHEMBL4790575 0.68 L3MBTL1 (0.46) PKMMEN1GAAKMT2A
SCHEMBL4272799 0.67 MCL1 (0.51) PKMALDH1A1GAA
SCHEMBL5446748 0.66 KEAP1 (0.56) KEAP1NFE2L2ALDH1A1MEN1MAPT
SCHEMBL22857621 0.66 TRPA1 (0.34) ALDH1A1

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
EP-2616450-A2 SULFONAMIDE COMPOUNDS Kancera AB (SE) 2013-07-24 EP disclosed
WO-2012035171-A2 NEW COMPOUNDS KANCERA AB (SE) 2012-03-22 WO disclosed