SCHEMBL8773904

SCHEMBL8773904

CC(C)C[C@H](NC(=O)C(CCCc1ccccc1)CC(=O)OC(C)(C)C)C(=O)O

nearest known ligand 0.56

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
MME P08473 2/20 0.53
MMP2 P08253 11/20 0.49
MMP3 P08254 8/20 0.49
MMP7 P09237 2/20 0.49
MMP1 P03956 2/20 0.49
MMP9 P14780 2/20 0.47
MMP12 P39900 1/20 0.47
MMP13 P45452 1/20 0.47

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
SCHEMBL8773895 0.95 MME (0.54) MMEMMP2MMP3MMP7MMP1
SCHEMBL4634106 0.82 MMP1 (0.70) MMP2MMP3MMP7MMP1MMP9
SCHEMBL4634107 0.82 MMP1 (0.70) MMP2MMP3MMP7MMP1MMP9
SCHEMBL27573505 0.82 MMP1 (0.70) MMP2MMP3MMP7MMP1MMP9
SCHEMBL9066930 0.82 BIRC2 (0.46) MMEMMP3MMP9
SCHEMBL8773906 0.81 MME (0.55) MMEMMP2MMP7MMP9MMP12
SCHEMBL5400156 0.81 GRIK1 (0.54) MMP2MMP3MMP1MMP9
SCHEMBL5400150 0.81 GRIK1 (0.54) MMP2MMP3MMP1MMP9
SCHEMBL8469705 0.81 MMP2 (0.50) MMP2MMP3MMP7MMP1MMP9
SCHEMBL6834457 0.80 GRIK1 (0.52) MMP2MMP3MMP1MMP9

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0793643-A1 MATRIX METALLOPROTEASE INHIBITORS SYNTEX (U.S.A.) INC. (US) 1997-09-10 EP disclosed
WO-1996016027-A1 MATRIX METALLOPROTEASE INHIBITORS SYNTEX (U.S.A.) INC. (US) 1996-05-30 WO disclosed