SCHEMBL5033280

SCHEMBL5033280

CN1C(=O)N(C[C@@H](N)C(=O)OC(C)(C)C)C(=O)C1(C)C

nearest known ligand 0.41

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
MMP2 P08253 16/20 0.41
MMP1 P03956 14/20 0.41
MMP13 P45452 9/20 0.41
MMP9 P14780 9/20 0.41
MMP8 P22894 5/20 0.41
MMP3 P08254 10/20 0.39
ADAM17 P78536 3/20 0.39
PLA2G7 Q13093 2/20 0.36
MMP7 P09237 2/20 0.35
MMP14 P50281 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
SCHEMBL5033281 1.00 MMP2 (0.41) MMP2MMP1MMP13MMP9MMP8
SCHEMBL7424768 0.76 PLA2G7 (0.34) MMP2MMP1MMP13MMP9MMP8
SCHEMBL16096222 0.75 ALDH1A1 (0.41)
SCHEMBL16096223 0.75 ALDH1A1 (0.41)
SCHEMBL7221727 0.74 MMP2 (0.37) MMP2MMP1MMP13MMP9MMP8
SCHEMBL7368800 0.73 MMP1 (0.37) MMP2MMP1MMP13MMP9MMP8
SCHEMBL7078769 0.73 MMP2 (0.36) MMP2MMP1MMP13MMP9MMP8
SCHEMBL7078766 0.72 MMP2 (0.36) MMP2MMP1MMP13MMP9MMP8
SCHEMBL7603860 0.71 PLA2G7 (0.40) MMP2MMP1MMP13MMP9MMP8
SCHEMBL5033284 0.71 CYP2D6 (0.31) PLA2G7

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 3 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