SCHEMBL6507709

SCHEMBL6507709

NCC(=O)SC(c1ccccc1)(c1ccccc1)c1ccccc1

nearest known ligand 0.47

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
▸ KIF11 P52732 19/20 0.47
▸ DNMT1 P26358 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
SCHEMBL929816 0.82 KIF11 (0.41) KIF11DNMT1
SCHEMBL5528317 0.80 CYP2C19 (0.42) KIF11
SCHEMBL7729593 0.80 PTPN1 (0.42) KIF11DNMT1
SCHEMBL6363065 0.77 CES2 (0.43) KIF11
SCHEMBL22966169 0.76 CYP1A2 (0.44) KIF11DNMT1
SCHEMBL3188913 0.74 CES2 (0.49) KIF11
SCHEMBL8188401 0.73 CHRM2 (0.47) —
SCHEMBL27415070 0.72 KIF11 (0.45) KIF11
Succinic Acid SCHEMBL7482968 0.72 NR4A2 (0.45) KIF11DNMT1
SCHEMBL4800015 0.70 FFAR1 (0.46) —

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-6953788-B1 3-mercaptoacetylamino-1,5-substituted-2-oxo-azepan derivatives useful as inhibitors of matrix metalloproteinase AVENTIS PHARMACEUTICALS INC. (US) 2005-10-11 — — US disclosed
US-6770640-B1 EMPHYSEMA AVENTIS PHARMACEUTICALS INC. 2004-08-03 — — US disclosed
CN-1150205-C 3-mercaptoacetylamino-1,5-subsd. 2-oxo-azepon derivatives useful as inhibitor of metrix metalloproteinase ���µ�˹ҩ�﹫˾ 2004-05-19 — — CN disclosed
EP-0928291-B1 3-MERCAPTOACETYLAMINO-1,5-SUBSTITUTED-2-OXO-AZEPAN DERIVATIVES USEFUL AS INHIBITORS OF MATRIX METALLOPROTEINASE AVENTIS PHARMA INC (US) 2002-12-04 — — EP disclosed
EP-1150975-A1 1-CARBOXYMETHYL-2-OXO-AZEPAN DERIVATIVES USEFUL AS SELECTIVE INHIBITORS OF MMP-12 Aventis Pharmaceuticals Inc. (US) 2001-11-07 — — EP disclosed
WO-2000040577-A1 1-CARBOXYMETHYL-2-OXO-AZEPAN DERIVATIVES USEFUL AS SELECTIVE INHIBITORS OF MMP-12 AVENTIS PHARMACEUTICALS INC. (US) 2000-07-13 — — WO disclosed
EP-0751783-B1 HYPOCHOLESTEROLEMIC, ANTIATHEROSCLEROTIC AND HYPOTRIGLYCERIDEMIC USE OF AMINOACETYLMERCAPTO DERIVATIVES MERRELL PHARMA INC (US) 2000-02-02 — — EP disclosed
CN-1234039-A 3-mercaptoacetylamino-1, 5-disubstituted-2-oxo-azepane derivatives as matrix metalloproteinase inhibitors HOECHST MARION ROUSSEL INC (US) 1999-11-03 — — CN disclosed
EP-0928291-A1 3-MERCAPTOACETYLAMINO-1,5-SUBSTITUTED-2-OXO-AZEPAN DERIVATIVES USEFUL AS INHIBITORS OF MATRIX METALLOPROTEINASE HOECHST MARION ROUSSEL, INC. (US) 1999-07-14 — — EP disclosed
EP-0625987-B1 AMINOACETYLMERCAPTOACETYLAMIDE DERIVATIVES USEFUL AS INHIBITORS OF ENKEPHALINASE AND ACE MERRELL PHARMA INC (US) 1998-04-01 — — EP disclosed
WO-1998012211-A1 3-MERCAPTOACETYLAMINO-1,5-SUBSTITUTED-2-OXO-AZEPAN DERIVATIVES USEFUL AS INHIBITORS OF MATRIX METALLOPROTEINASE HOECHST MARION ROUSSEL, INC. (US) 1998-03-26 — — WO disclosed
US-5624921-A Hypotriglyceridemic aminoacetylmercapto derivatives MERRELL PHARMACEUTICALS INC. (US) 1997-04-29 — — US disclosed
US-5602122-A Method for lowering total serum cholesterol and treating hypercholesterolemia with aminoacetylmercapto derivatives MERRELL PHARMACEUTICALS INC. (US) 1997-02-11 — — US disclosed
EP-0751783-A1 HYPOCHOLESTEROLEMIC, ANTIATHEROSCLEROTIC AND HYPOTRIGLYCERIDEMIC AMINOACETYLMERCAPTO DERIVATIVES MERRELL PHARMACEUTICALS INC. (US) 1997-01-08 — — EP disclosed
US-5529995-A Aminoacetylmercapto derivatives useful as inhibitors of enkephalinase and ACE MERRELL DOW PHARMACEUTICALS INC. (US) 1996-06-25 — — US disclosed
US-5488048-A Aminoacetylmercapto derivatives useful as inhibitors of enkephalinase and ace MERRELL DOW PHARMACEUTICALS INC. (US) 1996-01-30 — — US disclosed
WO-1995025532-A1 HYPOCHOLESTEROLEMIC, ANTIATHEROSCLEROTIC AND HYPOTRIGLYCERIDEMIC AMINOACETYLMERCAPTO DERIVATIVES MERRELL PHARMACEUTICALS INC. (US) 1995-09-28 — — WO disclosed
US-5424425-A Aminoacetylmercapto derivatives useful as inhibitors of enkephalinase and ace MERRELL DOW PHARMACEUTICALS INC. (US) 1995-06-13 — — US disclosed
EP-0625987-A1 AMINOACETYLMERCAPTOACETYLAMIDE DERIVATIVES USEFUL AS INHIBITORS OF ENKEPHALINASE AND ACE MERRELL PHARMACEUTICALS INC. (US) 1994-11-30 — — EP disclosed
WO-1993016103-A1 AMINOACETYLMERCAPTOACETYLAMIDE DERIVATIVES USEFUL AS INHIBITORS OF ENKEPHALINASE AND ACE MERRELL DOW PHARMACEUTICALS INC. (US) 1993-08-19 — — WO disclosed
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