SCHEMBL8484275

SCHEMBL8484275

CCOc1ccc(OCC[C@H](CC(=O)NO)C(=O)N[C@@H](Cc2ccccc2)C(=O)NC)cc1

nearest known ligand 0.79

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
MMP3 P08254 17/20 0.79
MMP1 P03956 17/20 0.79
MMP9 P14780 5/20 0.79
MMP2 P08253 11/20 0.77
FCER2 P06734 1/20 0.68
MMP7 P09237 7/20 0.67
MMP8 P22894 6/20 0.66

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
SCHEMBL8487053 0.95 MMP3 (0.84) MMP3MMP1MMP9MMP2FCER2
SCHEMBL8480892 0.94 MMP3 (0.89) MMP3MMP1MMP9MMP2FCER2
SCHEMBL8487985 0.92 MMP1 (0.79) MMP3MMP1MMP9MMP2FCER2
SCHEMBL8481777 0.91 MMP2 (0.66) MMP3MMP1MMP9MMP2MMP7
SCHEMBL2638859 0.88 MMP3 (1.00) MMP3MMP1MMP9MMP2FCER2
SCHEMBL8482048 0.87 MMP3 (0.84) MMP3MMP1MMP9MMP2FCER2
SCHEMBL2639291 0.87 MMP3 (1.00) MMP3MMP1MMP9MMP2FCER2
SCHEMBL8484845 0.87 MMP1 (0.74) MMP3MMP1MMP9MMP2FCER2
SCHEMBL8484210 0.87 MMP3 (0.89) MMP3MMP1MMP9MMP2MMP7
SCHEMBL8486757 0.87 MMP1 (0.70) MMP3MMP1MMP9MMP2MMP7

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-5990158-A EXTRACELLULAR MATRIX METALLOPROTEINASES INHIBITORS; ORAL ADMINISTRATION; BIOAVAILABILITY; E.G.,N-(2-(2'-(5-METHYL-2-OXO-1,3-DIOXOL-4-YL)METHYLENE-OXY-2'-OXO-ETHYL)-5 -(4-METH-OXYPHENYL)OXY)PENTANOYL)PHENYLALANINE N-METHYLAMIDE KOTOBUKI SEIYAKU CO., LTD. (JP) 1999-11-23 US disclosed