SCHEMBL8970831

SCHEMBL8970831

CNC(=O)[C@H](Cc1ccccc1)NC(=O)[C@H](CCCCOCc1ccccc1)CC(=O)O

nearest known ligand 0.83

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
MMP1 P03956 15/20 0.83
MMP3 P08254 14/20 0.83
MMP8 P22894 5/20 0.83
MMP9 P14780 5/20 0.83
MMP2 P08253 12/20 0.73
MMP7 P09237 2/20 0.60

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
SCHEMBL2639074 0.91 MMP3 (1.00) MMP1MMP3MMP8MMP9MMP2
SCHEMBL2639787 0.90 MMP3 (1.00) MMP1MMP3MMP8MMP9MMP2
SCHEMBL8971222 0.89 MMP1 (0.76) MMP1MMP3MMP8MMP9MMP2
SCHEMBL8828119 0.88 MMP1 (0.83) MMP1MMP3MMP8MMP9MMP2
SCHEMBL2639839 0.88 MMP3 (1.00) MMP1MMP3MMP8MMP9MMP2
SCHEMBL8828144 0.85 MMP1 (0.81) MMP1MMP3MMP8MMP9MMP2
SCHEMBL8060171 0.84 MMP2 (1.00) MMP1MMP3MMP8MMP9MMP2
SCHEMBL8057881 0.84 MMP2 (1.00) MMP1MMP3MMP8MMP9MMP2
SCHEMBL8053749 0.84 MMP2 (1.00) MMP1MMP3MMP8MMP9MMP2
SCHEMBL8053894 0.84 MMP2 (1.00) MMP1MMP3MMP8MMP9MMP2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-5514716-A MATRIX METALLOPROTEINASE INHIBITORS, ANTIARTHRITIC STERLING WINTHROP, INC. (US) 1996-05-07 US disclosed