SCHEMBL6976625

SCHEMBL6976625

CCCCCCCSc1nc2ccc(S(=O)(=O)N[C@H](CC3=CC=C(CCCN4C(=O)c5ccccc5C4=O)CC3=O)C(=O)NO)cc2s1

nearest known ligand 0.38

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 3/20 0.38
MMP1 P03956 3/20 0.38
MMP2 P08253 3/20 0.38
MMP9 P14780 3/20 0.38
MMP14 P50281 3/20 0.38
ADAM17 P78536 3/20 0.38
PPARA Q07869 6/20 0.38
PPARG P37231 5/20 0.38
ADAM10 O14672 1/20 0.35
MEN1 O00255 1/20 0.35
CYP2C9 P11712 1/20 0.35
KMT2A Q03164 1/20 0.35
PPARD Q03181 2/20 0.34
MAPK1 P28482 1/20 0.33
MAPT P10636 2/20 0.33
HTT P42858 1/20 0.32
LDHA P00338 1/20 0.32
SOAT1 P35610 1/20 0.32
MMP13 P45452 1/20 0.32

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
SCHEMBL5756026 0.94 PPARG (0.40) ALDH1A1PPARAPPARGMEN1CYP2C9
SCHEMBL6969845 0.90 PPARA (0.41) MMP1MMP2MMP9MMP14PPARA
SCHEMBL6978363 0.89 PPARA (0.41) MMP2MMP9PPARAPPARGMEN1
SCHEMBL6976961 0.84 PPARG (0.43) PPARAPPARGMEN1CYP2C9KMT2A
SCHEMBL6976507 0.83 PPARG (0.43) PPARAPPARGMEN1CYP2C9KMT2A
SCHEMBL5756506 0.83 MMP1 (0.44) ALDH1A1MMP1MMP2MMP9MMP14
SCHEMBL6976528 0.80 ALDH1A1 (0.42) ALDH1A1MMP1MMP2MMP9MMP14
SCHEMBL5756354 0.80 MAPT (0.40) ALDH1A1MMP2MMP9MEN1CYP2C9
SCHEMBL5754992 0.79 MMP2 (0.49) MMP2MMP9MMP14PPARAPPARG
SCHEMBL5757499 0.78 MMP2 (0.50) MMP1MMP2MMP9MMP14PPARA

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
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