SCHEMBL8041132

SCHEMBL8041132

CCCCS(=O)(=O)N(CC(=O)NO)Cc1ccccc1

nearest known ligand 0.58

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
BMP1 P13497 3/20 0.58
MMP1 P03956 4/20 0.53
MMP13 P45452 4/20 0.53
CA1 P00915 1/20 0.53
CA2 P00918 1/20 0.53
MMP2 P08253 1/20 0.53
MMP9 P14780 1/20 0.53
MMP8 P22894 1/20 0.53
ALDH1A1 P00352 1/20 0.50
CNR2 P34972 2/20 0.47
MEP1B Q16820 3/20 0.46
MEP1A Q16819 1/20 0.46
MMP3 P08254 2/20 0.46
GAA P10253 1/20 0.45
MMP7 P09237 3/20 0.45
MMP12 P39900 3/20 0.45
ACE P12821 2/20 0.45
TP53 P04637 1/20 0.45
MAPT P10636 1/20 0.45
MEN1 O00255 1/20 0.45

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
SCHEMBL6411529 0.95 BMP1 (0.53) BMP1MMP1MMP13CA1CA2
SCHEMBL7918690 0.83 CA1 (0.60) MMP1MMP13CA1CA2MMP2
SCHEMBL12711081 0.83 CNR2 (0.55) CA2ALDH1A1CNR2
SCHEMBL8038085 0.83 BMP1 (0.69) BMP1MMP1MMP13MMP9CNR2
SCHEMBL8027595 0.83 BMP1 (0.69) BMP1MMP1MMP13MMP9CNR2
SCHEMBL6412306 0.83 BMP1 (0.54) BMP1MMP1MMP13MMP2MMP9
SCHEMBL8038049 0.83 BMP1 (0.62) BMP1MMP1MMP13CA1CA2
SCHEMBL6417009 0.81 BMP1 (0.53) BMP1MMP1MMP13CA1CA2
SCHEMBL8038065 0.79 CNR2 (0.59) BMP1MMP1MMP13CA1CA2
SCHEMBL8037741 0.79 CNR2 (0.59) BMP1MMP1MMP13CA1CA2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-6124329-A AN ENZYME INHIBITOR FOR THE TREATMENT OR PROPHYLAXIS OF TISSUE BREAKDOWN, FOR EXAMPLE RHEUMATOID ARTHRITIS, OSTEOPOROSIS, PERIODONTITIS, GINGIVITIS, CORNEAL EPIDERMAL OR GASTRIC ULCERATION, AND TUMOR, MULTIPLE SCLEROSIS BRITISH BIOTECH PHARMACEUTICALS LTD. (GB) 2000-09-26 US disclosed
EP-0766664-B1 METALLOPROTEINASE INHIBITORS BRITISH BIOTECH PHARM (GB) 2000-04-05 EP disclosed
EP-0766664-A2 METALLOPROTEINASE INHIBITORS BRITISH BIOTECH PHARMACEUTICALS LIMITED (GB) 1997-04-09 EP disclosed
WO-1995035275-A1 METALLOPROTEINASE INHIBITORS BRITISH BIOTECH PHARMACEUTICALS LIMITED (GB) 1995-12-28 WO disclosed