SCHEMBL6577392

SCHEMBL6577392

COC(=O)CC(CC(C)C)C(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)O

nearest known ligand 0.76

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ECE1 P42892 5/20 0.76
MMP2 P08253 10/20 0.71
MMP9 P14780 8/20 0.71
MMP8 P22894 8/20 0.71
MMP1 P03956 7/20 0.71
ADAM10 O14672 1/20 0.66
ADAM12 O43184 1/20 0.66
ADAMTS4 O75173 1/20 0.66
MMP3 P08254 1/20 0.66
MMP7 P09237 1/20 0.66
MMP12 P39900 1/20 0.66
MMP13 P45452 1/20 0.66
MMP14 P50281 1/20 0.66
MMP15 P51511 1/20 0.66
MMP16 P51512 1/20 0.66
ADAM17 P78536 1/20 0.66
ADAM9 Q13443 1/20 0.66
MMP26 Q9NRE1 1/20 0.66
MMP17 Q9ULZ9 1/20 0.66
ADAMTS5 Q9UNA0 1/20 0.66

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
SCHEMBL7371076 1.00 ECE1 (0.76) ECE1MMP2MMP9MMP8MMP1
SCHEMBL6578096 0.91 MMP2 (0.82) MMP2MMP9MMP8MMP1ADAM10
SCHEMBL851449 0.91 MMP2 (0.82) MMP2MMP9MMP8MMP1ADAM10
SCHEMBL6575025 0.91 MMP2 (0.85) ECE1MMP2MMP9MMP8MMP1
SCHEMBL4795667 0.91 MMP2 (0.85) ECE1MMP2MMP9MMP8MMP1
SCHEMBL6577835 0.89 MMP1 (0.68) MMP2MMP9MMP8MMP1ADAM10
SCHEMBL6575260 0.89 MMP2 (0.66) ECE1MMP2MMP9MMP8MMP1
SCHEMBL4845965 0.88 MMP2 (0.84) ECE1MMP2MMP9MMP8MMP1
SCHEMBL9068557 0.87 ECE1 (1.00) ECE1ACE
SCHEMBL6431194 0.86 ECE1 (0.79) ECE1MMP2MMP9MMP8MMP1

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 32 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0558648-B1 IMPROVED MATRIX METALLOPROTEASE INHIBITORS GALARDY RICHARD E (US) 2004-04-28 EP disclosed
US-6187907-B1 CONJUGATE OF THREE CROSSLINKED POLYPEPTIDE CHAINS CONTAINING TRIPEPTIDE OR HEXAPEPTIDE REPEAT SEQUENCES ALIGNED TO FORM TRIPLE HELIX COIL AND LIGAND COVALENTLY ATTATCHED TO TEMPLATE; MODELING; DRUG SCREENING CHEN JAMES (US) 2001-02-13 US disclosed
EP-0663823-B1 INHIBITION OF ANGIOGENESIS BY SYNTHETIC MATRIX METALLOPROTEASE INHIBITORS GLYCOMED INC (US) 2000-11-22 EP disclosed
WO-2000012538-A1 TRIPLE HELIX COIL TEMPLATE HAVING A BIOLOGICALLY ACTIVE LIGAND CHEN JAMES (US) 2000-03-09 WO disclosed
US-5892112-A ACYLATION OF AMINO ACIDS WITH ANHYDRIDES OR CARBOXY GROUPS, AMIDATION WITH AMINE AND CONVERSION OF ACID OR ESTER TO HYDROXAMIC ACID AND HYDROLYSIS GLYCOMED INCORPORATED (US) 1999-04-06 US disclosed
US-5773438-A SKIN DISORDERS, RESTENOSIS, RHEUMATIC ARTHRITIS, WOUND HEALING AGENTS, ANGIOGENESIS, SHOCK GLYCOMED INCORPORATED (US) 1998-06-30 US disclosed
EP-0558681-B1 TREATMENT FOR TISSUE ULCERATION UNIV FLORIDA (US) 1998-04-08 EP disclosed
EP-0558635-B1 IMPROVED MATRIX METALLOPROTEASE INHIBITORS GLYCOMED INC (US) 1997-09-10 EP disclosed
EP-0663823-A4 INHIBITION OF ANGIOGENESIS BY SYNTHETIC MATRIX METALLOPROTEASE INHIBITORS. GLYCOMED INC (US) 1997-06-04 EP disclosed
EP-0692931-A4 SYNTHETIC MATRIX METALLOPROTEASE INHIBITORS AND USES THEREOF GLYCOMED INC (US) 1996-03-20 EP disclosed
EP-0558648-A1 IMPROVED MATRIX METALLOPROTEASE INHIBITORS GALARDY, Richard, E. (US) 1993-09-08 EP disclosed
EP-0558635-A1 IMPROVED MATRIX METALLOPROTEASE INHIBITORS. GLYCOMED INC (US) 1993-09-08 EP disclosed
US-5239078-A Collagenase enzyme inhibitors GLYCOMED INCORPORATED (US) 1993-08-24 US disclosed
WO-1993013741-A2 INHIBITION OF ANGIOGENESIS BY SYNTHETIC MATRIX METALLOPROTEASE INHIBITORS GLYCOMED, INC. (US) 1993-07-22 WO disclosed
US-5189178-A Preventing protein destruction GALARDY RICHARD E (US) 1993-02-23 US disclosed
US-5183900-A Matrix metalloprotease inhibitors GALARDY RICHARD E (US) 1993-02-02 US disclosed
WO-1992009563-A1 IMPROVED MATRIX METALLOPROTEASE INHIBITORS GLYCOMED, INC. (US) 1992-06-11 WO disclosed
WO-1992009556-A1 IMPROVED MATRIX METALLOPROTEASE INHIBITORS GALARDY RICHARD E (US) 1992-06-11 WO disclosed
WO-1992009282-A1 TREATMENT FOR TISSUE ULCERATION THE UNIVERSITY OF FLORIDA RESEARCH FOUNDATION, INC. (US) 1992-06-11 WO disclosed
US-5114953-A Peptides UNIVERSITY OF FLORIDA (US) 1992-05-19 US disclosed