SCHEMBL7477399

SCHEMBL7477399

CC(C)[C@H](NS(N)(=O)=O)C(=O)O

nearest known ligand 0.47

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
MMP2 P08253 10/20 0.47
MMP3 P08254 8/20 0.47
MMP13 P45452 8/20 0.47
MMP9 P14780 8/20 0.47
MMP1 P03956 7/20 0.47
MMP7 P09237 7/20 0.47
KDM4E B2RXH2 1/20 0.47
ADAMTS4 O75173 4/20 0.46
CA2 P00918 2/20 0.45
CA1 P00915 1/20 0.45
MMP14 P50281 1/20 0.44
GAA P10253 1/20 0.42
MAPT P10636 1/20 0.42
NPSR1 Q6W5P4 1/20 0.42
CA12 O43570 1/20 0.42
CA14 Q9ULX7 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
SCHEMBL7477404 1.00 MMP2 (0.47) MMP2MMP3MMP13MMP9MMP1
SCHEMBL5839738 0.79 KDM4E (0.49) MMP2MMP3MMP13MMP9MMP1
SCHEMBL29612792 0.79 KDM4E (0.49) MMP2MMP3MMP13MMP9MMP1
SCHEMBL5839741 0.79 KDM4E (0.49) MMP2MMP3MMP13MMP9MMP1
SCHEMBL7337633 0.78 CA14 (0.70) CA2CA1CA12CA14
SCHEMBL7337628 0.78 CA14 (0.70) CA2CA1CA12CA14
SCHEMBL13612445 0.77 KDM4E (0.47) MMP2MMP3MMP13MMP9MMP1
SCHEMBL9115909 0.77 KDM4E (0.47) MMP2MMP3MMP13MMP9MMP1
SCHEMBL7319253 0.76 ADAMTS4 (0.43) MMP2MMP3MMP13MMP9MMP1
SCHEMBL5314799 0.76 ADAMTS4 (0.43) MMP2MMP3MMP13MMP9MMP1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0794956-A4 SUBSTITUTED 2-(PHOSPHINYLOXYMETHYL)-1,2,5-THIADIAZOLIDIN-3-ONE 1,1-DIOXIDES AND COMPOSITIONS AND METHOD OF USE THEREOF SANOFI WINTHROP INC (US) 1998-02-11 EP disclosed
EP-0801648-A4 SUBSTITUTED 2-ARYLCARBONYLOXYMETHYL-1,2,5-THIADIAZOLIDIN-3-ONE 1,1-DIOXIDE DERIVATIVES AND COMPOSITIONS AND METHOD OF USE THEREOF SANOFI WINTHROP INC (US) 1998-01-28 EP disclosed
EP-0801648-A1 SUBSTITUTED 2-ARYLCARBONYLOXYMETHYL-1,2,5-THIADIAZOLIDIN-3-ONE 1,1-DIOXIDE DERIVATIVES AND COMPOSITIONS AND METHOD OF USE THEREOF SANOFI WINTHROP, INC. (US) 1997-10-22 EP disclosed
EP-0794956-A1 SUBSTITUTED 2-(PHOSPHINYLOXYMETHYL)-1,2,5-THIADIAZOLIDIN-3-ONE 1,1-DIOXIDES AND COMPOSITIONS AND METHOD OF USE THEREOF SANOFI WINTHROP, INC. (US) 1997-09-17 EP disclosed
WO-1996016951-A1 SUBSTITUTED 2-ARYLCARBONYLOXYMETHYL-1,2,5-THIADIAZOLIDIN-3-ONE 1,1-DIOXIDE DERIVATIVES AND COMPOSITIONS AND METHOD OF USE THEREOF SANOFI WINTHROP, INC. (US) 1996-06-06 WO disclosed