SCHEMBL7534393

SCHEMBL7534393

CN(C(C(=O)NO)C1CCCCC1)S(=O)(=O)c1ccc(Oc2ccc(F)cc2)cc1

nearest known ligand 0.47

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
ADAMTS7 Q9UKP4 1/20 0.47
ADAMTS5 Q9UNA0 1/20 0.47
MMP1 P03956 13/20 0.46
MMP13 P45452 11/20 0.44
MMP2 P08253 7/20 0.42
MMP9 P14780 6/20 0.42
ADAM17 P78536 4/20 0.42
FFAR1 O14842 1/20 0.42
MMP3 P08254 5/20 0.41
MMP8 P22894 3/20 0.41
MMP14 P50281 1/20 0.40
MMP16 P51512 1/20 0.40

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
SCHEMBL7534389 1.00 ADAMTS7 (0.47) ADAMTS7ADAMTS5MMP1MMP13MMP2
SCHEMBL7534479 0.90 MMP1 (0.46) ADAMTS7ADAMTS5MMP1MMP13MMP2
SCHEMBL7534476 0.90 MMP1 (0.46) ADAMTS7ADAMTS5MMP1MMP13MMP2
SCHEMBL7535443 0.89 MMP1 (0.46) ADAMTS7ADAMTS5MMP1MMP13MMP2
SCHEMBL7535439 0.89 MMP1 (0.46) ADAMTS7ADAMTS5MMP1MMP13MMP2
SCHEMBL7531012 0.89 ADAMTS7 (0.51) ADAMTS7ADAMTS5MMP1MMP13MMP2
SCHEMBL7531009 0.89 ADAMTS7 (0.51) ADAMTS7ADAMTS5MMP1MMP13MMP2
SCHEMBL7535242 0.88 MMP13 (0.48) ADAMTS7ADAMTS5MMP1MMP13MMP2
SCHEMBL7535249 0.88 MMP13 (0.48) ADAMTS7ADAMTS5MMP1MMP13MMP2
SCHEMBL7540158 0.87 MMP13 (0.49) ADAMTS7ADAMTS5MMP1MMP13MMP2

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
US-H1992-H1 INHIBITION OF METALLOPROTEINASES AND TUMOR NECROSIS FACTOR CONVERTASE WHICH DEGRADE PROTEIN COMPONENTS OF EXTRACELLULAR MATRIX AGOURON PHARMACEUTICALS, INC. 2001-09-04 US claimed
WO-1998050348-A1 METALLOPROTEINASE INHIBITORS, PHARMACEUTICAL COMPOSITIONS CONTAINING THEM AND THEIR PHARMACEUTICAL USES AGOURON PHARMACEUTICALS, INC. (US) 1998-11-12 WO claimed
US-H1992-H1 INHIBITION OF METALLOPROTEINASES AND TUMOR NECROSIS FACTOR CONVERTASE WHICH DEGRADE PROTEIN COMPONENTS OF EXTRACELLULAR MATRIX AGOURON PHARMACEUTICALS, INC. 2001-09-04 US disclosed
WO-1998050348-A1 METALLOPROTEINASE INHIBITORS, PHARMACEUTICAL COMPOSITIONS CONTAINING THEM AND THEIR PHARMACEUTICAL USES AGOURON PHARMACEUTICALS, INC. (US) 1998-11-12 WO disclosed