SCHEMBL5756031

SCHEMBL5756031

CCCCCCCSc1nc2ccc(S(=O)(=O)Nc3cccc(OCCCN4C(=O)c5ccccc5C4=O)c3OC(=O)CC)cc2s1

nearest known ligand 0.39

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 3/20 0.39
GLO1 Q04760 1/20 0.39
PPARG P37231 3/20 0.38
PPARA Q07869 3/20 0.38
MAPT P10636 8/20 0.37
LMNA P02545 3/20 0.37
TP53 P04637 2/20 0.37
KMT2A Q03164 1/20 0.36
NPSR1 Q6W5P4 1/20 0.36
SMN1; SMN2 Q16637 2/20 0.36
MAPK1 P28482 2/20 0.36
PPARD Q03181 1/20 0.36
HTT P42858 2/20 0.35

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
SCHEMBL6976963 0.88 PPARG (0.41) GLO1PPARGPPARAMAPTLMNA
SCHEMBL6976510 0.88 PPARG (0.41) GLO1PPARGPPARAMAPTLMNA
SCHEMBL6976531 0.87 ALDH1A1 (0.42) ALDH1A1GLO1MAPTLMNATP53
SCHEMBL6979299 0.86 CTSD (0.42) ALDH1A1GLO1MAPTLMNATP53
SCHEMBL6976460 0.86 PPARA (0.42) ALDH1A1GLO1PPARGPPARAMAPT
SCHEMBL5756033 0.76 LDHA (0.43) ALDH1A1PPARGPPARAMAPTLMNA
SCHEMBL5756506 0.75 MMP1 (0.44) ALDH1A1PPARGPPARAMAPTLMNA
SCHEMBL5756026 0.70 PPARG (0.40) ALDH1A1PPARGPPARAMAPTLMNA
SCHEMBL6976625 0.68 ALDH1A1 (0.38) ALDH1A1PPARGPPARAMAPTKMT2A
SCHEMBL10532228 0.68 ALDH1A1 (0.47) ALDH1A1MAPTLMNAKMT2ANPSR1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1208092-B1 SULFONAMIDE DERIVATIVE AS A MATRIX METALLOPROTEINASE INHIBITOR SAMSUNG ELECTRONICS CO LTD (KR) 2006-06-21 EP disclosed
EP-1208092-A4 SULFONAMIDE DERIVATIVE AS A MATRIX METALLOPROTEINASE INHIBITOR SAMSUNG ELECTRONICS CO LTD (KR) 2003-01-02 EP disclosed
EP-1208092-A1 SULFONAMIDE DERIVATIVE AS A MATRIX METALLOPROTEINASE INHIBITOR SAMSUNG ELECTRONICS CO., LTD. (KR) 2002-05-29 EP disclosed
WO-2001077092-A1 SULFONAMIDE DERIVATIVE AS A MATRIX METALLOPROTEINASE INHIBITOR SAMSUNG ELECTRONICS CO., LTD. (KR) 2001-10-18 WO disclosed