SCHEMBL7416701

SCHEMBL7416701

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

nearest known ligand 0.60

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 2/20 0.58
MMP13 P45452 6/20 0.58
MMP9 P14780 4/20 0.58
MMP1 P03956 3/20 0.58
MMP2 P08253 2/20 0.58
CA1 P00915 1/20 0.58
CA2 P00918 1/20 0.58
MMP8 P22894 1/20 0.58
BMP1 P13497 8/20 0.55
HSD17B10 Q99714 2/20 0.54
HPGD P15428 1/20 0.53
CA12 O43570 1/20 0.52
CA9 Q16790 1/20 0.52
CA14 Q9ULX7 1/20 0.52
ADAM17 P78536 2/20 0.52

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
SCHEMBL5226437 0.89 MMP13 (0.58) MMP13MMP9MMP1MMP2CA1
SCHEMBL1565606 0.89 MMP13 (0.58) MMP13MMP9MMP1MMP2CA1
SCHEMBL7461414 0.88 MMP13 (0.56) MMP13MMP9MMP1MMP2CA1
SCHEMBL7417246 0.86 MMP7 (0.65) ALDH1A1MMP13MMP9MMP1MMP2
SCHEMBL13570807 0.86 MMP2 (0.62) ALDH1A1MMP13MMP9MMP1MMP2
SCHEMBL11887788 0.86 MMP2 (0.62) ALDH1A1MMP13MMP9MMP1MMP2
SCHEMBL13643222 0.86 MMP2 (0.57) ALDH1A1MMP13MMP9MMP1MMP2
SCHEMBL13570499 0.86 MMP2 (0.62) ALDH1A1MMP13MMP9MMP1MMP2
SCHEMBL13639185 0.86 MMP2 (0.57) ALDH1A1MMP13MMP9MMP1MMP2
SCHEMBL7411093 0.85 MMP13 (0.60) MMP13MMP9MMP1MMP2MMP8

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