SCHEMBL7419690

SCHEMBL7419690

CC(C)[C@@H](NS(=O)(=O)c1ccc(Br)cc1)C(=O)NO

nearest known ligand 0.91

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
MMP2 P08253 9/20 0.91
MMP1 P03956 9/20 0.91
MMP9 P14780 9/20 0.91
MMP13 P45452 9/20 0.91
MMP3 P08254 8/20 0.91
MMP7 P09237 8/20 0.91
MMP14 P50281 1/20 0.69
ADAM17 P78536 2/20 0.60
SLC1A3 P43003 1/20 0.56
SLC1A2 P43004 1/20 0.56
SLC1A1 P43005 1/20 0.56

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
SCHEMBL7082523 0.96 MMP2 (1.00) MMP2MMP1MMP9MMP13MMP3
SCHEMBL7380443 0.86 MMP13 (0.77) MMP2MMP1MMP9MMP13MMP3
SCHEMBL7380440 0.86 MMP13 (0.77) MMP2MMP1MMP9MMP13MMP3
SCHEMBL27611876 0.86 MMP2 (0.91) MMP2MMP1MMP9MMP13MMP3
SCHEMBL8283336 0.86 MMP2 (0.91) MMP2MMP1MMP9MMP13MMP3
SCHEMBL7414131 0.84 MMP2 (0.68) MMP2MMP1MMP9MMP13MMP3
SCHEMBL7376000 0.84 MMP9 (0.74) MMP2MMP1MMP9MMP13MMP3
SCHEMBL32691800 0.84 MMP2 (0.80) MMP2MMP1MMP9MMP13MMP3
SCHEMBL31086964 0.84 MMP1 (0.67) MMP2MMP1MMP9MMP13MMP3
SCHEMBL7375998 0.84 MMP9 (0.74) MMP2MMP1MMP9MMP13MMP3

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
US-6218389-B1 FOR THERAPY AND PROPHYLAXIS OF ARTHRITIS, CANCER, CARDIOVASCULAR DISORDERS; SKIN DISORDERS; OCULAR DISORDERS; INFLAMMATION AND GUM DISEASES, MULTIPLE SCLEROSIS, CACHEXIA, PREVENTING LOOSENING OF PROSTHETIC DEVICES THE PROCTER & GAMBLE CO. 2001-04-17 US disclosed
EP-1009737-A2 SULFONYLAMINO SUBSTITUTED HYDROXAMIC ACID DERIVATIVES AS METALLOPROTEASE INHIBITORS THE PROCTER & GAMBLE COMPANY (US) 2000-06-21 EP disclosed
WO-1999006340-A2 SULFONYLAMINO SUBSTITUTED HYDROXAMIC ACID DERIVATIVES AS METALLOPROTEASE INHIBITORS THE PROCTER & GAMBLE COMPANY (US) 1999-02-11 WO disclosed