SCHEMBL5034658

SCHEMBL5034658

O=C(NO)[C@@H](CCCN1C(=O)c2ccccc2C1=O)NS(=O)(=O)c1ccc(-c2ccc(Cl)cc2)cc1

nearest known ligand 0.68

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
MMP2 P08253 13/20 0.68
MMP9 P14780 12/20 0.68
MMP1 P03956 5/20 0.68
MMP14 P50281 5/20 0.68
ADAM17 P78536 4/20 0.68
ADAM10 O14672 1/20 0.57
MMP3 P08254 1/20 0.52
MMP13 P45452 1/20 0.52
BMP1 P13497 1/20 0.52
ADAMTS5 Q9UNA0 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
SCHEMBL7945656 0.94 MMP2 (0.77) MMP2MMP9MMP1MMP14ADAM17
SCHEMBL7954067 0.91 MMP2 (0.64) MMP2MMP9MMP1MMP14ADAM17
SCHEMBL5033356 0.90 MMP2 (0.69) MMP2MMP9MMP1MMP14ADAM17
SCHEMBL7959937 0.90 MMP2 (0.69) MMP2MMP9MMP1MMP14ADAM17
Hydroxyamine SCHEMBL7688383 0.88 MMP2 (0.67) MMP2MMP9MMP1MMP14ADAM17
SCHEMBL5031591 0.85 MMP2 (0.55) MMP2MMP9MMP1MMP14ADAM17
SCHEMBL1379757 0.84 MMP2 (0.52) MMP2MMP9MMP1MMP14ADAM17
SCHEMBL5033750 0.84 MMP2 (0.56) MMP2MMP9MMP1MMP14ADAM17
SCHEMBL7954530 0.83 MMP2 (0.68) MMP2MMP9MMP1MMP14ADAM17
SCHEMBL7945731 0.81 MMP2 (0.57) MMP2MMP9MMP1MMP14ADAM17

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 5 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1918278-A1 Sulfonylamino derivatives which inhibit matrix-degrading metalloproteinases Novartis AG (CH) 2008-05-07 EP disclosed
US-6410580-B1 ANTIINFLAMMATORY AGENTS, RHEUMATIC DISEASES NOVARTIS AG (CH) 2002-06-25 US disclosed
US-6277987-B1 FOR INHIBITING MATRIX-DEGRADING METALLOPROTEINASES IN MAMMALS NOVARTIS AG (CH) 2001-08-21 US disclosed
EP-1053226-A1 SULFONYLAMINO DERIVATIVES WHICH INHIBIT MATRIX-DEGRADING METALLOPROTEINASES Novartis AG (CH) 2000-11-22 EP disclosed
WO-1999042443-A1 SULFONYLAMINO DERIVATIVES WHICH INHIBIT MATRIX-DEGRADING METALLOPROTEINASES NOVARTIS AG (CH) 1999-08-26 WO disclosed