SCHEMBL7353097

SCHEMBL7353097

COC(=O)NCCS(=O)(=O)N1CCN(S(=O)(=O)c2ccc(-c3ccc(Cl)cc3)s2)[C@@H](C(=O)NO)C1

nearest known ligand 0.43

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
MMP1 P03956 9/20 0.43
MMP13 P45452 9/20 0.43
MMP9 P14780 8/20 0.43
MMP3 P08254 7/20 0.43
MMP7 P09237 7/20 0.43
ADAM17 P78536 2/20 0.39
GAA P10253 2/20 0.37
MEN1 O00255 1/20 0.37
KMT2A Q03164 1/20 0.37
ALDH1A1 P00352 1/20 0.37

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
SCHEMBL7055845 1.00 MMP1 (0.43) MMP1MMP13MMP9MMP3MMP7
SCHEMBL7057133 0.90 MEN1 (0.36) MMP1MMP13MMP9MMP3MMP7
SCHEMBL7057190 0.89 MMP3 (0.41) MMP1MMP13MMP9MMP3MMP7
SCHEMBL7352231 0.88 MMP3 (0.40) MMP1MMP13MMP9MMP3MMP7
SCHEMBL7680133 0.86 MMP13 (0.39) MMP1MMP13MMP9MMP3MMP7
SCHEMBL7680126 0.86 MMP13 (0.39) MMP1MMP13MMP9MMP3MMP7
SCHEMBL7058579 0.85 MMP3 (0.53) MMP1MMP13MMP9MMP3MMP7
SCHEMBL7052103 0.84 MMP1 (0.41) MMP1MMP13MMP9MMP3MMP7
SCHEMBL7056970 0.83 MMP9 (0.44) MMP1MMP13MMP9MMP3MMP7
SCHEMBL7057754 0.81 MMP3 (0.43) MMP1MMP13MMP9MMP3MMP7

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-6489324-B2 TREATING STROKE, ARHTRITIS, CANCER, TISSUE ULCERATION, DECUBITIS ULCER, RESTENOSIS, PERIODONTAL DISEASE, EPIDERMOLYSIS BULLOSA, SCLERITIS, PSORIASIS, AIDS, SEPSIS, AND SEPTIC SHOCK. FUJISAWA PHARMACEUTICAL CO., LTD. (JP) 2002-12-03 US disclosed
US-6333324-B1 FOR THERAPY AND PROPHYLAXIS OF MATRIX METALLOPROTEINASES (MMP) OR TUMOR NECROSIS FACTOR .ALPHA. (TNF.ALPHA.), MEDIATED DISEASES FUJISAWA PHARMACEUTICAL CO., LTD. (JP) 2001-12-25 US disclosed
EP-0948489-A1 PIPERAZINE COMPOUNDS AS INHIBITORS OF MMP OR TNF FUJISAWA PHARMACEUTICAL CO., LTD. (JP) 1999-10-13 EP disclosed
WO-1998027069-A1 PIPERAZINE COMPOUNDS AS INHIBITORS OF MMP OR TNF FUJISAWA PHARMACEUTICAL CO., LTD. (JP) 1998-06-25 WO disclosed