SCHEMBL11223913

SCHEMBL11223913

CS(=O)(=O)Nc1ccccc1OS(C)(=O)=O

nearest known ligand 0.50

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KEAP1 Q14145 3/20 0.50
L3MBTL1 Q9Y468 1/20 0.50
NFE2L2 Q16236 1/20 0.47
PTGS1 P23219 4/20 0.47
PTGS2 P35354 3/20 0.47
HSD17B10 Q99714 2/20 0.46
KMT2A Q03164 2/20 0.45
SLC22A12 Q96S37 1/20 0.44
KDM4E B2RXH2 2/20 0.43
HPGD P15428 2/20 0.43
ALDH1A1 P00352 1/20 0.43
NR3C1 P04150 1/20 0.43
PGR P06401 1/20 0.43
NR3C2 P08235 1/20 0.43
AR P10275 1/20 0.43
EP300 Q09472 1/20 0.43
KAT2B Q92831 1/20 0.43
KAT8 Q9H7Z6 1/20 0.43
TSHR P16473 2/20 0.43
PIN1 Q13526 1/20 0.43

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
SCHEMBL6378390 0.84 PTGS1 (0.56) KEAP1L3MBTL1NFE2L2PTGS1PTGS2
SCHEMBL4860020 0.82 PTGS1 (0.63) L3MBTL1PTGS1KMT2ASLC22A12KDM4E
SCHEMBL1797703 0.79 KEAP1 (0.49) KEAP1L3MBTL1NFE2L2PTGS1PTGS2
SCHEMBL3839152 0.79 NFE2L2 (0.42) KEAP1L3MBTL1NFE2L2PTGS2KMT2A
SCHEMBL29904739 0.79 KEAP1 (0.65) KEAP1L3MBTL1NFE2L2PTGS1PTGS2
SCHEMBL2068498 0.79 KEAP1 (0.65) KEAP1L3MBTL1NFE2L2PTGS1PTGS2
SCHEMBL3405309 0.78 CYP19A1 (0.56) KEAP1L3MBTL1NFE2L2PTGS1PTGS2
SCHEMBL8719438 0.78 PTGS2 (0.68) KEAP1L3MBTL1PTGS1PTGS2HSD17B10
SCHEMBL12355350 0.78 KEAP1 (0.47) KEAP1L3MBTL1NFE2L2PTGS1PTGS2
SCHEMBL22187328 0.78 POLB (0.51) HSD17B10KMT2AKDM4EHPGDALDH1A1

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
US-4349378-A Compounds useful as pesticides FBC LIMITED (GB) 1982-09-14 US disclosed
US-4309559-A PLANT GROWTH REGULATORS AND ESPECIALLY FUNGICIDES OR HERBICIDES FBC LIMITED (GB) 1982-01-05 US disclosed