SCHEMBL5679507

SCHEMBL5679507

CC(C)C[C@@H](C(=O)O)[C@H](CCCN)C(=O)OC(C)(C)C

nearest known ligand 0.38

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CPB2 Q96IY4 5/20 0.37
MEN1 O00255 1/20 0.35
GAA P10253 1/20 0.35
KMT2A Q03164 1/20 0.35
GABRR1 P24046 2/20 0.33
SLC7A5 Q01650 1/20 0.33
CTSL P07711 1/20 0.33
CTSB P07858 1/20 0.33
CTSS P25774 1/20 0.33
CTSK P43235 1/20 0.33
NOS1 P29475 2/20 0.32
FOLH1 Q04609 1/20 0.32
NOS3 P29474 1/20 0.32
NOS2 P35228 1/20 0.32
GSR P00390 1/20 0.32
TDP1 Q9NUW8 2/20 0.31
XBP1 P17861 1/20 0.31
RECQL P46063 1/20 0.31
POLB P06746 1/20 0.31
NPSR1 Q6W5P4 1/20 0.31

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
SCHEMBL6981664 0.91 GABRR1 (0.39) MEN1GAAKMT2AGABRR1SLC7A5
SCHEMBL6981662 0.91 GABRR1 (0.39) MEN1GAAKMT2AGABRR1SLC7A5
SCHEMBL7977210 0.85 MEN1 (0.35) MEN1GAAKMT2ASLC7A5CTSL
SCHEMBL7977209 0.85 MEN1 (0.35) MEN1GAAKMT2ASLC7A5CTSL
SCHEMBL7762836 0.84 CTSL (0.39) MEN1GAAKMT2ASLC7A5CTSL
SCHEMBL7518209 0.84 CTSL (0.39) MEN1GAAKMT2ASLC7A5CTSL
SCHEMBL7518207 0.84 CTSL (0.39) MEN1GAAKMT2ASLC7A5CTSL
SCHEMBL15015766 0.84 CTSL (0.39) MEN1GAAKMT2ASLC7A5CTSL
SCHEMBL7838358 0.83 CTSK (0.35) MEN1GAAKMT2ASLC7A5CTSL
SCHEMBL7838363 0.83 CTSK (0.35) MEN1GAAKMT2ASLC7A5CTSL

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0934292-B1 METALLOPROTEINASE INHIBITORS VERNALIS OXFORD LTD (GB) 2006-03-15 EP disclosed
EP-1066273-A1 METALLOPROTEINASE INHIBITORS BRITISH BIOTECH PHARMACEUTICALS LIMITED (GB) 2001-01-10 EP disclosed
US-6022873-A Metalloproteinase inhibitors BRITISH BIOTECH PHARMACEUTICALS LIMITED (GB) 2000-02-08 US disclosed
WO-1999048881-A1 METALLOPROTEINASE INHIBITORS BRITISH BIOTECH PHARMACEUTICALS LIMITED (GB) 1999-09-30 WO disclosed
EP-0934292-A1 METALLOPROTEINASE INHIBITORS BRITISH BIOTECH PHARMACEUTICALS LIMITED (GB) 1999-08-11 EP disclosed
WO-1998017655-A1 METALLOPROTEINASE INHIBITORS BRITISH BIOTECH PHARMACEUTICALS LIMITED (GB) 1998-04-30 WO disclosed