SCHEMBL7070048

SCHEMBL7070048

CCCCCCCCCCCCCCCCC(CC(=O)NO)C(=O)NC(C(=S)NC)C(C)(C)C

nearest known ligand 0.80

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
MMP3 P08254 15/20 0.80
MMP2 P08253 14/20 0.80
MMP1 P03956 12/20 0.80
MMP7 P09237 5/20 0.80
MMP9 P14780 5/20 0.80
PDF Q9HBH1 1/20 0.61
BIRC2 Q13490 2/20 0.55
MMP14 P50281 1/20 0.55

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
SCHEMBL7070053 1.00 MMP3 (0.80) MMP3MMP2MMP1MMP7MMP9
SCHEMBL8398532 0.89 MMP3 (1.00) MMP3MMP2MMP1MMP7MMP9
SCHEMBL14545737 0.89 MMP3 (1.00) MMP3MMP2MMP1MMP7MMP9
SCHEMBL8400266 0.84 MMP3 (0.77) MMP3MMP2MMP1MMP7MMP9
SCHEMBL8397206 0.82 MMP3 (0.79) MMP3MMP2MMP1MMP7MMP9
SCHEMBL8396712 0.82 MMP3 (0.79) MMP3MMP2MMP1MMP7MMP9
SCHEMBL8397183 0.81 PDF (0.90) MMP3MMP2MMP1MMP7MMP9
SCHEMBL7383365 0.81 BIRC2 (0.69) MMP3MMP2MMP1MMP7MMP9
SCHEMBL7969452 0.81 BIRC2 (0.69) MMP3MMP2MMP1MMP7MMP9
SCHEMBL4818599 0.79 MMP3 (0.82) MMP3MMP2MMP1MMP7MMP9

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-1060161-B1 MATRIX METALLOPROTEINASE INHIBITORS LEO PHARMA AS WITH SECONDARY N (DK) 2003-06-11 EP claimed
US-6277876-B1 Matrix metalloproteinase inhibitors LEO PHARMACEUTICAL PRODUCTS LTD. A/S (DK) 2001-08-21 US claimed
EP-1060161-B1 MATRIX METALLOPROTEINASE INHIBITORS LEO PHARMA AS WITH SECONDARY N (DK) 2003-06-11 EP disclosed
US-6277876-B1 Matrix metalloproteinase inhibitors LEO PHARMACEUTICAL PRODUCTS LTD. A/S (DK) 2001-08-21 US disclosed