SCHEMBL6607741

SCHEMBL6607741

Cc1ccc(S(=O)(=O)OCCCCCOc2ccc3ccccc3n2)cc1

nearest known ligand 0.47

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 3/20 0.47
KMT2A Q03164 3/20 0.47
MAPT P10636 1/20 0.47
KDM4E B2RXH2 4/20 0.45
KEAP1 Q14145 1/20 0.43
NFE2L2 Q16236 1/20 0.43
CA12 O43570 1/20 0.41
CA1 P00915 1/20 0.41
CA9 Q16790 1/20 0.41
GFER P55789 1/20 0.40
ALDH1A1 P00352 3/20 0.39
GAA P10253 1/20 0.39
ADAMTS4 O75173 1/20 0.39
POLB P06746 2/20 0.39
NCF1 P14598 1/20 0.38
LTB4R Q15722 1/20 0.38
ALPL P05186 1/20 0.38
CYP24A1 Q07973 1/20 0.37
PTGS1 P23219 1/20 0.36
PTGS2 P35354 1/20 0.36

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
SCHEMBL6609131 0.80 GRM2 (0.41) MAPTKDM4EKEAP1NFE2L2CA12
SCHEMBL6604282 0.80 GRM2 (0.41) MAPTKDM4EKEAP1NFE2L2CA12
SCHEMBL6606551 0.80 GRM2 (0.41) MAPTKDM4EKEAP1NFE2L2CA12
SCHEMBL6603226 0.80 GRM2 (0.41) MAPTKDM4EKEAP1NFE2L2CA12
SCHEMBL19222682 0.79 KEAP1 (0.58) MEN1KMT2AKDM4EKEAP1NFE2L2
SCHEMBL8484861 0.78 ALDH1A1 (0.48) CA12CA1CA9ALDH1A1GAA
SCHEMBL4951882 0.78 ALDH1A1 (0.48) CA12CA1CA9ALDH1A1GAA
SCHEMBL11050599 0.78 ALDH1A1 (0.48) CA12CA1CA9ALDH1A1GAA
SCHEMBL4815560 0.78 ALDH1A1 (0.48) CA12CA1CA9ALDH1A1GAA
SCHEMBL4812770 0.78 ALDH1A1 (0.48) CA12CA1CA9ALDH1A1GAA

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
US-6787561-B1 HYPERLIPIDEMIA, ARTERIOSCLEROSIS; ORAL ADMINISTRATION; SUPPRESSING THE FORMING OF MACROPHAGES FUJI PHOTO FILM CO., LTD. (JP) 2004-09-07 US disclosed
EP-1197493-B1 BENZIMIDAZOLE COMPOUNDS FUJI PHOTO FILM CO LTD (JP) 2004-03-24 EP disclosed
EP-1197493-A1 BENZIMIDAZOLE COMPOUNDS FUJI PHOTO FILM CO., LTD. (JP) 2002-04-17 EP disclosed