SCHEMBL4609253

SCHEMBL4609253

CC(C)[C@H](NS(=O)(=O)c1ccc(-c2ccc([AsH2])cc2)cc1)C(=O)O

nearest known ligand 0.78

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
MMP2 P08253 15/20 0.78
MMP9 P14780 13/20 0.78
MMP3 P08254 12/20 0.78
MMP13 P45452 12/20 0.78
MMP1 P03956 11/20 0.78
MMP7 P09237 11/20 0.78
ADAMTS4 O75173 4/20 0.78
MMP14 P50281 1/20 0.74
MMP8 P22894 1/20 0.71

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
SCHEMBL4609258 1.00 MMP2 (0.78) MMP2MMP9MMP3MMP13MMP1
SCHEMBL32691806 0.88 MMP2 (1.00) MMP2MMP9MMP3MMP13MMP1
SCHEMBL1750956 0.88 MMP2 (1.00) MMP2MMP9MMP3MMP13MMP1
SCHEMBL4653257 0.88 MMP2 (1.00) MMP2MMP9MMP3MMP13MMP1
SCHEMBL7870625 0.87 MMP2 (1.00) MMP2MMP9MMP3MMP13MMP1
SCHEMBL8283899 0.87 ADAMTS4 (1.00) MMP2MMP9MMP3MMP13MMP1
SCHEMBL1655901 0.87 ADAMTS4 (1.00) MMP2MMP9MMP3MMP13MMP1
SCHEMBL7870619 0.87 MMP2 (1.00) MMP2MMP9MMP3MMP13MMP1
SCHEMBL5806025 0.86 MMP2 (0.60) MMP2MMP9MMP3MMP13MMP1
SCHEMBL7406967 0.85 MMP2 (1.00) MMP2MMP9MMP3MMP13MMP1

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
EP-1885694-A2 4-BIARYLYL-1-PHENYLAZETIDIN-2-ONES Microbia, Inc. (US) 2008-02-13 EP disclosed
EP-1877373-A2 BIPHENYLAZETIDINONE CHOLESTEROL ABSORPTION INHIBITORS Microbia, Inc. (US) 2008-01-16 EP disclosed
WO-2006124713-A2 4-BIARYLYL-1-PHENYLAZETIDIN-2-ONES MICROBIA, INC. (US) 2006-11-23 WO disclosed
WO-2006121861-A2 BIPHENYLAZETIDINONE CHOLESTEROL ABSORPTION INHIBITORS MICROBIA, INC. (US) 2006-11-16 WO disclosed