SCHEMBL7320048

SCHEMBL7320048

COC(=O)[C@@H]1CCCN1Cc1cccc(C(=O)O)c1N(C)S(=O)(=O)c1ccc(OC)cc1

nearest known ligand 0.84

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
MMP1 P03956 12/20 0.84
MMP9 P14780 12/20 0.84
MMP13 P45452 12/20 0.84
ADAM17 P78536 12/20 0.84
GFER P55789 1/20 0.44
LMNA P02545 1/20 0.42
KMT2A Q03164 1/20 0.42
LTA4H P09960 2/20 0.42
HCRTR1 O43613 1/20 0.42
HCRTR2 O43614 1/20 0.42
SMN1; SMN2 Q16637 1/20 0.41
KDM4E B2RXH2 1/20 0.41
ALDH1A1 P00352 1/20 0.41

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
SCHEMBL7348749 0.91 MMP9 (1.00) MMP1MMP9MMP13ADAM17
SCHEMBL7355486 0.91 MMP9 (1.00) MMP1MMP9MMP13ADAM17
SCHEMBL7554630 0.89 MMP1 (0.78) MMP1MMP9MMP13ADAM17GFER
SCHEMBL7318146 0.89 MMP1 (0.78) MMP1MMP9MMP13ADAM17GFER
SCHEMBL27563881 0.88 MMP1 (0.65) MMP1MMP9MMP13ADAM17GFER
SCHEMBL7320044 0.82 MMP1 (0.60) MMP1MMP9MMP13ADAM17LTA4H
SCHEMBL7316221 0.79 MMP1 (0.81) MMP1MMP9MMP13ADAM17GFER
SCHEMBL27510260 0.77 MMP1 (0.61) MMP1MMP9MMP13ADAM17GFER
SCHEMBL27511019 0.76 KEAP1 (0.57) MMP1MMP9MMP13ADAM17GFER
SCHEMBL7348743 0.75 MMP13 (0.70) MMP1MMP9MMP13ADAM17LTA4H

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0938471-B1 THE PREPARATION AND USE OF ORTHO-SULFONAMIDO ARYL HYDROXAMIC ACIDS AS MATRIX METALLOPROTEINASE AND TACE INHIBITORS AMERICAN CYANAMID CO (US) 2001-12-12 EP disclosed
EP-0938471-A1 THE PREPARATION AND USE OF ORTHO-SULFONAMIDO ARYL HYDROXAMIC ACIDS AS MATRIX METALLOPROTEINASE AND TACE INHIBITORS American Cyanamid Company (US) 1999-09-01 EP disclosed
US-5929097-A INHIBIT TUMOR NECROSIS FACTOR-ALPHA CONVERTING ENZYME AMERICAN CYANAMID COMPANY (US) 1999-07-27 US disclosed
WO-1998016503-A2 THE PREPARATION AND USE OF ORTHO-SULFONAMIDO ARYL HYDROXAMIC ACIDS AS MATRIX METALLOPROTEINASE AND TACE INHIBITORS AMERICAN CYANAMID COMPANY (US) 1998-04-23 WO disclosed