SCHEMBL7951099

SCHEMBL7951099

NC(=O)C1(CS(=O)(=O)c2ccc(OCc3cccc4cnccc34)cc2)CCN(O)CC1

nearest known ligand 0.46

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
ADAM17 P78536 13/20 0.46
MMP1 P03956 6/20 0.46
PARP10 Q53GL7 1/20 0.40
MMP13 P45452 11/20 0.40
MMP2 P08253 7/20 0.40
MEN1 O00255 2/20 0.40
KMT2A Q03164 2/20 0.40
ALDH1A1 P00352 1/20 0.40
MAPK1 P28482 1/20 0.40
HTT P42858 1/20 0.39
MMP14 P50281 2/20 0.39
MMP9 P14780 1/20 0.39

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
SCHEMBL7942802 0.85 MMP1 (0.44) ADAM17MMP1MMP13MMP2MMP9
SCHEMBL7950401 0.82 MMP1 (0.50) ADAM17MMP1MMP13MMP2MMP9
SCHEMBL7363680 0.79 ADAM17 (0.55) ADAM17MMP1MMP13MMP2MMP14
SCHEMBL7355311 0.79 MMP13 (0.54) ADAM17MMP1MMP13MMP2MMP14
SCHEMBL7424285 0.77 ADAM17 (0.43) ADAM17MMP1MMP13MMP2MEN1
SCHEMBL7427223 0.76 ADAM17 (0.42) ADAM17MMP1MMP13MMP2MEN1
SCHEMBL7427244 0.76 ADAM17 (0.42) ADAM17MMP1MMP13MMP2MEN1
SCHEMBL7424174 0.75 ADAM17 (0.40) ADAM17MMP1MMP13MMP2MEN1
SCHEMBL7358650 0.67 ADAM17 (0.61) ADAM17MMP1MMP13MMP2MMP14
SCHEMBL7354231 0.64 ADAM17 (0.62) ADAM17MMP1MMP13MMP2MMP14

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
US-6268379-B1 Substituted aryl hydroxamic acids as metalloproteinase inhibitors DUPONT PHARMACEUTICALS COMPANY 2001-07-31 US claimed
US-6268379-B1 Substituted aryl hydroxamic acids as metalloproteinase inhibitors DUPONT PHARMACEUTICALS COMPANY 2001-07-31 US disclosed