SCHEMBL7342633

SCHEMBL7342633

COc1ccc(S(=O)(=O)N(Cc2cccnc2)[C@H](CC(C)C)C(=O)OC(C)(C)C)cc1

nearest known ligand 0.63

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
MMP9 P14780 15/20 0.63
MMP2 P08253 4/20 0.63
MMP13 P45452 12/20 0.49
MMP1 P03956 9/20 0.49
ADAM17 P78536 5/20 0.49
MMP8 P22894 2/20 0.49
ADAMTS4 O75173 1/20 0.48
ALDH1A1 P00352 1/20 0.47
ATM Q13315 1/20 0.46

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
SCHEMBL7342628 1.00 MMP9 (0.63) MMP9MMP2MMP13MMP1ADAM17
SCHEMBL13639252 0.91 MMP9 (0.65) MMP9MMP2MMP13MMP1ADAM17
SCHEMBL13639217 0.91 MMP9 (0.65) MMP9MMP2MMP13MMP1ADAM17
SCHEMBL25301517 0.91 MMP9 (0.67) MMP9MMP2MMP13MMP1ADAM17
SCHEMBL29521301 0.91 MMP9 (0.67) MMP9MMP2MMP13MMP1ADAM17
SCHEMBL25301518 0.91 MMP9 (0.67) MMP9MMP2MMP13MMP1ADAM17
SCHEMBL13639205 0.89 MMP9 (0.66) MMP9MMP2MMP13MMP1ADAM17
SCHEMBL13639187 0.89 MMP9 (0.66) MMP9MMP2MMP13MMP1ADAM17
SCHEMBL7345045 0.89 TAS2R14 (0.54) MMP9MMP2MMP13MMP8ALDH1A1
SCHEMBL7345042 0.89 TAS2R14 (0.54) MMP9MMP2MMP13MMP8ALDH1A1

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-0606046-B1 Arylsulfonamido-substituted hydroxamic acids CIBA GEIGY AG (CH) 1997-10-08 EP disclosed
US-5646167-A ADMINISTERED AS METALLOPROTEINASE INHIBITOR, ANTITUMOR OR ANTICARCINOGENIC AGENT CIBA-GEIGY CORPORATION (US) 1997-07-08 US disclosed
US-5506242-A METALLOELASTASE INHIBITOR; TREATS EMPHYSEMA CIBA-GEIGY CORPORATION (US) 1996-04-09 US disclosed
US-5455258-A Useful as inhibitors of matrix-degrading metalloproteinase enzymes such as stromelysin and/or collegenase CIBA-GEIGY CORPORATION (US) 1995-10-03 US disclosed
EP-0606046-A1 Arylsulfonamido-substituted hydroxamic acids CIBA-GEIGY AG (CH) 1994-07-13 EP disclosed