SCHEMBL7945656

SCHEMBL7945656

O=C(NO)[C@@H](CCN1C(=O)c2ccccc2C1=O)NS(=O)(=O)c1ccc(-c2ccc(Cl)cc2)cc1

nearest known ligand 0.77

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
MMP2 P08253 13/20 0.77
MMP9 P14780 12/20 0.77
MMP1 P03956 6/20 0.77
MMP14 P50281 5/20 0.77
ADAM17 P78536 4/20 0.77
ADAM10 O14672 1/20 0.64
ADAMTS5 Q9UNA0 1/20 0.51
MMP3 P08254 1/20 0.51
MMP13 P45452 1/20 0.51
BMP1 P13497 1/20 0.49

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
SCHEMBL5034658 0.94 MMP2 (0.68) MMP2MMP9MMP1MMP14ADAM17
SCHEMBL7954530 0.89 MMP2 (0.68) MMP2MMP9MMP1MMP14ADAM17
SCHEMBL7954067 0.85 MMP2 (0.64) MMP2MMP9MMP1MMP14ADAM17
SCHEMBL7409638 0.83 MMP2 (0.77) MMP2MMP9MMP1MMP14ADAM17
SCHEMBL7959937 0.83 MMP2 (0.69) MMP2MMP9MMP1MMP14ADAM17
SCHEMBL5033356 0.83 MMP2 (0.69) MMP2MMP9MMP1MMP14ADAM17
Hydroxyamine SCHEMBL7688383 0.82 MMP2 (0.67) MMP2MMP9MMP1MMP14ADAM17
SCHEMBL5034648 0.81 MMP2 (0.52) MMP2MMP9MMP1MMP14ADAM17
SCHEMBL7952666 0.81 MMP2 (0.67) MMP2MMP9MMP1ADAMTS5MMP3
SCHEMBL7952667 0.81 MMP2 (0.67) MMP2MMP9MMP1ADAMTS5MMP3

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-6277987-B1 FOR INHIBITING MATRIX-DEGRADING METALLOPROTEINASES IN MAMMALS NOVARTIS AG (CH) 2001-08-21 US disclosed