SCHEMBL6980252

SCHEMBL6980252

COc1ccc(CSc2nc3ccc(S(=O)(=O)N[C@@](C)(C(=O)O)C(C)C)cc3s2)cc1

nearest known ligand 0.52

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
MAPT P10636 9/20 0.52
LMNA P02545 5/20 0.52
L3MBTL1 Q9Y468 2/20 0.52
MAPK1 P28482 1/20 0.52
TP53 P04637 3/20 0.46
ALDH1A1 P00352 1/20 0.45
THRB P10828 1/20 0.45
POLB P06746 1/20 0.44
CA1 P00915 2/20 0.42
HTT P42858 1/20 0.42
TDP1 Q9NUW8 1/20 0.42
CTSL P07711 1/20 0.42
CTSB P07858 1/20 0.42
CTSK P43235 1/20 0.42

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
SCHEMBL5757635 0.83 MAPT (0.53) MAPTLMNAL3MBTL1MAPK1ALDH1A1
SCHEMBL5806540 0.80 MMP9 (0.54) MAPTLMNAL3MBTL1MAPK1TP53
SCHEMBL5758844 0.72 MAPT (0.56) MAPTLMNATP53ALDH1A1THRB
SCHEMBL5754134 0.72 HTT (0.52) MAPTTP53ALDH1A1THRBHTT
SCHEMBL5756019 0.70 MAPT (0.53) MAPTLMNATP53ALDH1A1THRB
SCHEMBL6966735 0.69 MMP13 (0.55)
SCHEMBL5756325 0.69 HTT (0.55) TP53ALDH1A1THRBHTT
SCHEMBL9353698 0.67 MAPT (0.67) MAPTLMNAL3MBTL1MAPK1TP53
SCHEMBL5755465 0.66 PPARG (0.45) MAPTLMNAL3MBTL1TP53HTT
SCHEMBL5756259 0.66 ALOX15 (0.53) TP53ALDH1A1HTT

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