SCHEMBL4673477

SCHEMBL4673477

COC(=O)C(NS(=O)(=O)N1CCN(c2ccc(Cl)cc2)CC1)C(C)C

nearest known ligand 0.48

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
MAPT P10636 5/20 0.48
TP53 P04637 2/20 0.48
MMP14 P50281 1/20 0.48
ADAMTS5 Q9UNA0 1/20 0.48
CCR1 P32246 1/20 0.47
SMN1; SMN2 Q16637 1/20 0.47
MEN1 O00255 4/20 0.47
KMT2A Q03164 4/20 0.47
MMP1 P03956 1/20 0.45
CA12 O43570 1/20 0.42
CA14 Q9ULX7 1/20 0.42
GAA P10253 1/20 0.42
HSD11B1 P28845 1/20 0.42
RORC P51449 1/20 0.41
OPRK1 P41145 1/20 0.41

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
SCHEMBL4673480 1.00 MAPT (0.48) MAPTTP53MMP14ADAMTS5CCR1
SCHEMBL13591208 0.89 MEN1 (0.47) MAPTMMP14SMN1; SMN2MEN1KMT2A
SCHEMBL4393673 0.88 CA12 (0.42) MAPTTP53MMP14ADAMTS5SMN1; SMN2
SCHEMBL4393669 0.88 CA12 (0.42) MAPTTP53MMP14ADAMTS5SMN1; SMN2
SCHEMBL4673727 0.88 MEN1 (0.52) MAPTTP53MMP14ADAMTS5CCR1
SCHEMBL4673723 0.88 MEN1 (0.52) MAPTTP53MMP14ADAMTS5CCR1
SCHEMBL13392314 0.88 ALDH1A1 (0.45) MAPTMMP14ADAMTS5SMN1; SMN2MEN1
SCHEMBL4674851 0.86 MMP1 (0.57) MAPTTP53MMP14ADAMTS5CCR1
SCHEMBL4674856 0.86 MMP1 (0.57) MAPTTP53MMP14ADAMTS5CCR1
SCHEMBL13392309 0.85 AKR1C3 (0.42) MAPTTP53MMP14ADAMTS5SMN1; SMN2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0958287-B2 SULFAMIDE-METALLOPROTEASE INHIBITORS HOFFMANN LA ROCHE (CH) 2008-04-09 EP disclosed
EP-0958287-B1 SULFAMIDE-METALLOPROTEASE INHIBITORS HOFFMANN LA ROCHE (CH) 2002-09-11 EP disclosed
US-6376506-B1 REACTING SULFAMOYL OXAZOLIDONE WITH (1,2,3,4)-TETRAHYDRO-BETA-CARBOLINE TO FORM INHIBITOR; USED TO TREAT ARTHRITIS, OSTEOPOROSIS, PERIODONTAL DISEASE, CARDIOVASCULAR DISEASES, MULTIPLE SCLEROSIS, AND TUMORS SYNTEX (U.S.A.) LLC 2002-04-23 US disclosed
US-6143744-A Sulfamide-metalloprotease inhibitors SYNTEX (U.S.A.) INC. (US) 2000-11-07 US disclosed
US-6130220-A ENZYME INHIBITORS SYNTEX (USA) INC. (US) 2000-10-10 US disclosed
US-5998412-A ANTIARTHRITIC AGENTS; OSTEOPOROSIS SYNTEX (U.S.A.) INC. (US) 1999-12-07 US disclosed
EP-0958287-A1 SULFAMIDE-METALLOPROTEASE INHIBITORS F. HOFFMANN-LA ROCHE AG (CH) 1999-11-24 EP disclosed
WO-1998032748-A1 SULFAMIDE-METALLOPROTEASE INHIBITORS F. HOFFMANN-LA ROCHE AG (CH) 1998-07-30 WO disclosed