SCHEMBL7404145

SCHEMBL7404145

Cc1cc(C2CCN(S(=O)(=O)C(C)(C)C(=O)N[O-])CC2)ccc1-c1cccc(C#N)c1.Cc1cc(C2CCN(S(=O)(=O)C(C)(C)C(=O)N[O-])CC2)ccc1-c1cccc(C#N)c1.[Pd+2]

nearest known ligand 0.59

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
MMP2 P08253 7/20 0.59
MMP3 P08254 7/20 0.59
MMP1 P03956 2/20 0.59
MMP9 P14780 2/20 0.59
MMP14 P50281 2/20 0.59
PAX8 Q06710 1/20 0.38
TLR9 Q9NR96 1/20 0.37
BCL9 O00512 2/20 0.36
CTNNB1 P35222 2/20 0.36
HCRTR2 O43614 1/20 0.36
MAP4K1 Q92918 1/20 0.36
CNR1 P21554 1/20 0.35
FASN P49327 1/20 0.35
CHRM3 P20309 1/20 0.35
L3MBTL1 Q9Y468 1/20 0.35
MCHR1 Q99705 2/20 0.35

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
SCHEMBL6584490 0.91 MMP3 (0.71) MMP2MMP3MMP1MMP9MMP14
SCHEMBL7404142 0.91 MMP3 (0.70) MMP2MMP3MMP1MMP9MMP14
SCHEMBL6438199 0.75 MMP3 (0.62) MMP2MMP3MMP1MMP9MMP14
SCHEMBL6585076 0.75 MMP3 (1.00) MMP2MMP3MMP1MMP9MMP14
SCHEMBL6585851 0.74 MMP3 (1.00) MMP2MMP3MMP1MMP9MMP14
Dimethylamine SCHEMBL6974207 0.73 MMP3 (0.97) MMP2MMP3MMP1MMP9MMP14
SCHEMBL6432618 0.73 MMP2 (0.67) MMP2MMP3MMP1MMP9MMP14
SCHEMBL6586804 0.73 MMP3 (1.00) MMP2MMP3MMP1MMP9MMP14
SCHEMBL6973528 0.73 MMP3 (1.00) MMP2MMP3MMP1MMP9MMP14
SCHEMBL6956464 0.73 MMP3 (0.81) MMP2MMP3MMP1MMP9MMP14

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-1036062-A1 HYDROXAMIC ACID DERIVATIVES AS MATRIX METALLOPROTEASE (MMP) INHIBITORS Pfizer Limited (GB) 2000-09-20 EP disclosed
WO-1999029667-A1 HYDROXAMIC ACID DERIVATIVES AS MATRIX METALLOPROTEASE (MMP) INHIBITORS PFIZER LIMITED (GB) 1999-06-17 WO disclosed