SCHEMBL7411865

SCHEMBL7411865

CNC(=O)[C@H](CC(C)C)NC(=O)N(O)C(=O)[C@@H](O)CCC(C)C

nearest known ligand 0.45

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
MMP2 P08253 4/20 0.45
MMP9 P14780 4/20 0.45
MMP8 P22894 3/20 0.45
MMP1 P03956 4/20 0.36
CAPN1 P07384 3/20 0.35
CAPN9 O14815 2/20 0.35
CTSB P07858 2/20 0.35
MAPK1 P28482 1/20 0.35
MMP3 P08254 3/20 0.35
CNR2 P34972 2/20 0.35
FOLH1 Q04609 2/20 0.33
LMNA P02545 2/20 0.33
ALDH1A1 P00352 2/20 0.33
MEN1 O00255 1/20 0.33
KMT2A Q03164 1/20 0.33
CTSL P07711 2/20 0.32
CTSG P08311 1/20 0.32
MMP13 P45452 1/20 0.32
MMP14 P50281 1/20 0.32

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
SCHEMBL7358000 0.83 BMP1 (0.34) MMP2MMP9MMP8
SCHEMBL7356614 0.80 MMP2 (0.49) MMP2MMP9MMP8MMP1MMP3
SCHEMBL7513209 0.80 MMP1 (0.44) MMP2MMP9MMP8MMP1MMP3
SCHEMBL9010568 0.78 MMP1 (0.35) MMP2MMP9MMP8MMP1MMP3
SCHEMBL7405014 0.78 SMN1; SMN2 (0.45) MMP2MMP9MMP1CAPN1MMP3
SCHEMBL8422654 0.77 MMP1 (0.34) MMP2MMP9MMP8MMP1MMP3
SCHEMBL8424797 0.77 MMP1 (0.32) MMP2MMP9MMP8MMP1MMP3
SCHEMBL8189731 0.77 MMP1 (0.32) MMP2MMP9MMP8MMP1MMP3
SCHEMBL9010596 0.76
SCHEMBL8198199 0.76 ADAM17 (0.34) MMP2MMP9MMP8MMP1MMP3

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
US-5919940-A TERT-LEUCINE-THIAZOL-2-YLAMIDE BRITISH BIOTECH PHARMACEUTICALS LIMITED (GB) 1999-07-06 US disclosed
US-5859253-A L-TERT-LEUCINE-2-PYRIDYLAMIDE BRITISH BIOTECH PHARMACEUTICALS LIMITED (GB) 1999-01-12 US disclosed
EP-0740652-B1 METALLOPROTEINASE INHIBITORS BRITISH BIOTECH PHARM (GB) 1998-05-06 EP disclosed
US-5747514-A Metalloproteinase inhibitors BRITISH BIOTECH PHARMACEUTICALS LIMITED (GB) 1998-05-05 US disclosed
EP-0740652-A1 METALLOPROTEINASE INHIBITORS BRITISH BIOTECH PHARMACEUTICALS LIMITED (GB) 1996-11-06 EP disclosed
WO-1995019956-A1 METALLOPROTEINASE INHIBITORS BRITISH BIOTECH PHARMACEUTICALS LIMITED (GB) 1995-07-27 WO disclosed