SCHEMBL6604282

SCHEMBL6604282

Cc1ccc(S(=O)(=O)OCCCCCCCCOc2ccccn2)cc1

nearest known ligand 0.42

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
GRM2 Q14416 1/20 0.41
CYP24A1 Q07973 1/20 0.40
ALDH1A1 P00352 6/20 0.39
PTGS2 P35354 1/20 0.39
KDM4E B2RXH2 3/20 0.39
LMNA P02545 2/20 0.39
MAPT P10636 1/20 0.39
HTT P42858 1/20 0.39
SMN1; SMN2 Q16637 1/20 0.39
TDP1 Q9NUW8 1/20 0.39
L3MBTL1 Q9Y468 1/20 0.39
CA12 O43570 1/20 0.39
CA1 P00915 1/20 0.39
CA9 Q16790 1/20 0.39
PSMD10 O75832 1/20 0.38
KEAP1 Q14145 1/20 0.38
NFE2L2 Q16236 1/20 0.38
VDR P11473 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
SCHEMBL6603226 1.00 GRM2 (0.41) GRM2CYP24A1ALDH1A1PTGS2KDM4E
SCHEMBL6606551 1.00 GRM2 (0.41) GRM2CYP24A1ALDH1A1PTGS2KDM4E
SCHEMBL6609131 1.00 GRM2 (0.41) GRM2CYP24A1ALDH1A1PTGS2KDM4E
SCHEMBL6607618 0.99 GRM2 (0.42) GRM2CYP24A1ALDH1A1PTGS2KDM4E
SCHEMBL8380811 0.92 CA12 (0.45) GRM2ALDH1A1PTGS2KDM4ELMNA
SCHEMBL6608554 0.85 ALDH1A1 (0.41) CYP24A1ALDH1A1KDM4ELMNAMAPT
SCHEMBL6604078 0.83 ALDH1A1 (0.44) CYP24A1ALDH1A1PTGS2KDM4ELMNA
SCHEMBL4951882 0.82 ALDH1A1 (0.48) CYP24A1ALDH1A1SMN1; SMN2CA12CA1
SCHEMBL4812770 0.82 ALDH1A1 (0.48) CYP24A1ALDH1A1SMN1; SMN2CA12CA1
SCHEMBL4815560 0.82 ALDH1A1 (0.48) CYP24A1ALDH1A1SMN1; SMN2CA12CA1

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