SCHEMBL7420442

SCHEMBL7420442

CCCCOc1ccc(S(=O)(=O)N[C@@H](C(=O)NO)C(C)C)cc1

nearest known ligand 0.69

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
MMP1 P03956 11/20 0.69
MMP9 P14780 11/20 0.69
MMP13 P45452 10/20 0.69
ADAM17 P78536 4/20 0.69
MMP2 P08253 8/20 0.66
MMP7 P09237 6/20 0.66
MMP3 P08254 5/20 0.66
PPARG P37231 1/20 0.59
MMP14 P50281 2/20 0.58
ADAM10 O14672 1/20 0.58
MMP8 P22894 1/20 0.58
ADAMTS4 O75173 1/20 0.58
ADAMTS5 Q9UNA0 1/20 0.58

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
SCHEMBL8108645 0.91 MMP1 (0.70) MMP1MMP9MMP13ADAM17MMP2
SCHEMBL2511972 0.91 MMP9 (0.68) MMP1MMP9MMP13ADAM17MMP2
SCHEMBL2511969 0.91 MMP9 (0.68) MMP1MMP9MMP13ADAM17MMP2
SCHEMBL2514060 0.90 MMP9 (0.67) MMP1MMP9MMP13ADAM17MMP2
SCHEMBL2514059 0.90 MMP9 (0.67) MMP1MMP9MMP13ADAM17MMP2
SCHEMBL2516073 0.89 MMP9 (0.65) MMP1MMP9MMP13ADAM17MMP2
SCHEMBL2516070 0.89 MMP9 (0.65) MMP1MMP9MMP13ADAM17MMP2
SCHEMBL7417303 0.87 MMP1 (0.68) MMP1MMP9MMP13ADAM17MMP2
SCHEMBL2515895 0.86 MMP9 (0.64) MMP1MMP9MMP13ADAM17MMP2
SCHEMBL2515899 0.86 MMP9 (0.64) MMP1MMP9MMP13ADAM17MMP2

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