SCHEMBL8456469

SCHEMBL8456469

CC(C)(C(=O)NO)N(Cc1cccnc1)S(=O)(=O)c1ccc(Oc2ccc(F)cc2)cc1

nearest known ligand 0.50

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
MMP9 P14780 17/20 0.50
MMP13 P45452 14/20 0.50
MMP1 P03956 12/20 0.50
MMP2 P08253 5/20 0.49
MMP8 P22894 1/20 0.48
ADAM17 P78536 7/20 0.47
NAMPT P43490 1/20 0.46

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
SCHEMBL13899009 0.79 MMP13 (0.52) MMP9MMP13MMP1MMP2MMP8
SCHEMBL231737 0.78 MMP1 (0.55) MMP9MMP13MMP1MMP2MMP8
SCHEMBL6809658 0.74 MMP13 (0.50) MMP9MMP13MMP1MMP2
SCHEMBL13898980 0.72 MMP9 (0.70) MMP9MMP13MMP1MMP2MMP8
SCHEMBL8443684 0.72 MMP1 (0.51) MMP9MMP13MMP1MMP2MMP8
SCHEMBL7000013 0.71 MMP13 (0.52) MMP9MMP13MMP1MMP2MMP8
SCHEMBL8455467 0.71 MMP9 (0.70) MMP9MMP13MMP1MMP2MMP8
SCHEMBL13899011 0.71 LMNA (0.47) MMP9MMP13MMP1MMP2MMP8
SCHEMBL7923801 0.70 MMP9 (0.77) MMP9MMP13MMP1MMP2MMP8
SCHEMBL4618781 0.70 MMP13 (0.55) MMP9MMP13MMP1MMP2MMP8

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-0935963-A2 The use of MMP-13 selective inhibitors for the treatment of osteoarthritis and other matrix metalloproteinase-mediated disorders Pfizer Products Inc. (US) 1999-08-18 EP claimed
EP-0935963-A2 The use of MMP-13 selective inhibitors for the treatment of osteoarthritis and other matrix metalloproteinase-mediated disorders Pfizer Products Inc. (US) 1999-08-18 EP disclosed