SCHEMBL28079452

SCHEMBL28079452

CC(C)(C)OC(=O)NS(=O)(=O)c1cccnc1

nearest known ligand 0.50

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
RAB9A P51151 1/20 0.50
PTGS2 P35354 5/20 0.49
NAMPT P43490 2/20 0.48
CA12 O43570 1/20 0.47
CA1 P00915 1/20 0.47
CA7 P43166 1/20 0.47
CA14 Q9ULX7 1/20 0.47
BRS3 P32247 1/20 0.47
NAPRT Q6XQN6 1/20 0.46
EGFR P00533 2/20 0.46
NLRP3 Q96P20 1/20 0.45
KEAP1 Q14145 1/20 0.45
NFE2L2 Q16236 1/20 0.45
SLC1A3 P43003 1/20 0.45
SLC1A2 P43004 1/20 0.45
SLC1A1 P43005 1/20 0.45
PTGS1 P23219 2/20 0.43
RORC P51449 1/20 0.43
CYP3A4 P08684 1/20 0.43
ABCC9 O60706 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
SCHEMBL30591339 0.85 PTGS2 (0.54) PTGS2NAPRTEGFRNLRP3KEAP1
SCHEMBL26282749 0.85 PTGS2 (0.54) PTGS2NAPRTEGFRNLRP3KEAP1
SCHEMBL5394506 0.82 CA1 (0.57) PTGS2CA12CA1CA7CA14
SCHEMBL12880366 0.81 PTGS2 (0.52) RAB9APTGS2NAPRTEGFRNLRP3
SCHEMBL6390027 0.80 HIF1A (0.50) PTGS2NAPRTEGFRNLRP3KEAP1
SCHEMBL2221393 0.79 HDAC8 (0.50) RAB9ANAMPT
SCHEMBL2221395 0.79 HDAC8 (0.50) RAB9ANAMPT
SCHEMBL15625451 0.79 PTGS2 (0.56) PTGS2NAPRTEGFRNLRP3KEAP1
SCHEMBL7088891 0.78 NAMPT (0.55) RAB9ANAMPTCA12CA1CA7
SCHEMBL9062856 0.77 ITGAV (0.59) RAB9ANAMPTSLC1A3SLC1A2SLC1A1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-105130855-B Succinylated hydroxy amine derivatives and application thereof 约翰斯霍普金斯大学 2018-05-25 CN disclosed
CN-105919987-A N-acyloxysulfonamide And N-hydroxy-n-acylsulfonamide Derivatives And Use Thereof 约翰斯霍普金斯大学 2016-09-07 CN disclosed
CN-102753520-B N-acyloxysulfonamide and N-hydroxy-N-acylsulfonamide derivatives 约翰斯霍普金斯大学 2016-06-08 CN disclosed