SCHEMBL8779849

SCHEMBL8779849

N#Cc1ccccc1S(=O)(=O)Br

nearest known ligand 0.58

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 2/20 0.58
HTT P42858 1/20 0.58
POLB P06746 1/20 0.46
SLC22A12 Q96S37 3/20 0.45
PKM P14618 1/20 0.44
LMNA P02545 1/20 0.43
HSD11B1 P28845 1/20 0.43
SLC40A1 Q9NP59 1/20 0.42
KAT6A Q92794 1/20 0.42
TSHR P16473 1/20 0.41
NR1H3 Q13133 1/20 0.39
KDM4E B2RXH2 2/20 0.39
ATM Q13315 1/20 0.38
KMT2A Q03164 1/20 0.38
CA1 P00915 1/20 0.38
CA2 P00918 1/20 0.38
USP8 P40818 1/20 0.38
USP7 Q93009 1/20 0.38

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
SCHEMBL8514629 0.82 ALDH1A1 (0.62) ALDH1A1HTTPOLBSLC22A12PKM
SCHEMBL30468568 0.82 ALDH1A1 (0.62) ALDH1A1HTTPOLBSLC22A12PKM
SCHEMBL4520419 0.80 ALDH1A1 (0.60) ALDH1A1HTTPOLBSLC22A12PKM
SCHEMBL2047783 0.80 ALDH1A1 (0.60) ALDH1A1HTTPOLBSLC22A12PKM
SCHEMBL3877411 0.78 ALDH1A1 (0.58) ALDH1A1HTTPOLBSLC22A12PKM
SCHEMBL489976 0.78 ALDH1A1 (0.58) ALDH1A1HTTPOLBSLC22A12PKM
SCHEMBL514820 0.78 ALDH1A1 (0.58) ALDH1A1HTTPOLBSLC22A12PKM
SCHEMBL514821 0.78 ALDH1A1 (0.63) ALDH1A1HTTPOLBSLC22A12PKM
SCHEMBL10658848 0.78 ALDH1A1 (0.58) ALDH1A1HTTPOLBSLC22A12PKM
SCHEMBL291455 0.78 CA2 (0.58) ALDH1A1HTTPOLBSLC22A12PKM

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-0770599-A1 PROCESS FOR THE PREPARATION OF AROMATIC OR HETEROAROMATIC SULFONYL HALIDES SUMITOMO SEIKA CHEMICALS CO., LTD. (JP) 1997-05-02 EP disclosed