SCHEMBL8915067

SCHEMBL8915067

CC(C)[C@H](NS(=O)(=O)c1ccccc1)C(=O)O.NC(=O)N1CCNCC1

nearest known ligand 0.56

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
MMP2 P08253 8/20 0.56
MMP9 P14780 8/20 0.56
ADAMTS4 O75173 8/20 0.56
MMP3 P08254 7/20 0.56
MMP13 P45452 7/20 0.56
MMP1 P03956 6/20 0.56
MMP7 P09237 6/20 0.56
SLC1A3 P43003 2/20 0.50
SLC1A2 P43004 2/20 0.50
SLC1A1 P43005 2/20 0.50
MMP12 P39900 1/20 0.49

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
SCHEMBL8912748 0.90 MMP2 (0.63) MMP2MMP9ADAMTS4MMP3MMP13
SCHEMBL8915384 0.88 ADAMTS4 (0.54) MMP2MMP9ADAMTS4MMP3MMP13
SCHEMBL6561375 0.81 MMP2 (0.82) MMP2MMP9ADAMTS4MMP3MMP13
SCHEMBL3973093 0.81 MMP2 (0.82) MMP2MMP9ADAMTS4MMP3MMP13
SCHEMBL21451101 0.81 MMP2 (0.82) MMP2MMP9ADAMTS4MMP3MMP13
SCHEMBL8914335 0.80 ALDH1A1 (0.45) MMP2MMP9ADAMTS4MMP3MMP13
SCHEMBL8915074 0.80 MMP2 (0.50) MMP2MMP9ADAMTS4MMP3MMP13
SCHEMBL8915076 0.80 MMP2 (0.59) MMP2MMP9ADAMTS4MMP3MMP13
SCHEMBL8916333 0.78 ADAMTS4 (0.48) MMP2MMP9ADAMTS4MMP3MMP13
SCHEMBL8913812 0.77 ROCK2 (0.51) MMP1SLC1A3SLC1A2SLC1A1

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
US-5663174-A ANTIINFLAMMATORY AGENTS, INHIBITOR OF KINASES, ANTIARTHRITIC AGENTS PHARNO-WEDROPHARM GMBH (DE) 1997-09-02 US disclosed
EP-0602028-B1 AROMATIC SULFONAMIDE DERIVATIVES, THEIR USE AS ENZYME INHIBITORS AND PHARMACEUTICAL COMPOSITIONS CONTAINING THEM PHARNO WEDROPHARM GMBH (DE) 1996-01-17 EP disclosed
EP-0602028-A1 AROMATIC SULFONAMIDE DERIVATIVES, THEIR USE AS ENZYME INHIBITORS AND PHARMACEUTICAL COMPOSITIONS CONTAINING THEM. PHARNO WEDROPHARM GMBH (DE) 1994-06-22 EP disclosed
WO-1993005014-A1 AROMATIC SULFONAMIDE DERIVATIVES, THEIR USE AS ENZYME INHIBITORS AND PHARMACEUTICAL COMPOSITIONS CONTAINING THEM PHARNO-WEDROPHARM GMBH (DE) 1993-03-18 WO disclosed