SCHEMBL7673950

SCHEMBL7673950

COc1ccc(S(=O)(=O)N2CCCN(C(C)=O)[C@H]2C(=O)NO)cc1

nearest known ligand 0.82

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
MMP1 P03956 20/20 0.82
MMP9 P14780 15/20 0.82
MMP3 P08254 13/20 0.82
MMP7 P09237 11/20 0.82
MMP13 P45452 12/20 0.64
MMP12 P39900 1/20 0.61
MMP2 P08253 4/20 0.59
MMP8 P22894 4/20 0.59

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
SCHEMBL7077683 0.91 MMP1 (1.00) MMP1MMP9MMP3MMP7MMP13
SCHEMBL7683951 0.86 MMP1 (0.74) MMP1MMP9MMP3MMP7MMP13
SCHEMBL7509736 0.85 MMP1 (1.00) MMP1MMP9MMP3MMP7MMP13
SCHEMBL11933919 0.81 MMP1 (0.90) MMP1MMP9MMP3MMP7MMP13
SCHEMBL7349862 0.80 MMP1 (0.91) MMP1MMP9MMP3MMP7MMP13
SCHEMBL7763139 0.79 MMP1 (0.98) MMP1MMP9MMP3MMP7MMP13
SCHEMBL7533064 0.78 MMP1 (0.91) MMP1MMP9MMP3MMP7MMP13
SCHEMBL7533059 0.78 MMP1 (0.91) MMP1MMP9MMP3MMP7MMP13
SCHEMBL6981692 0.78 MMP1 (1.00) MMP1MMP9MMP3MMP7MMP13
SCHEMBL7393667 0.78 MMP1 (1.00) MMP1MMP9MMP3MMP7MMP13

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 2 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-6465474-B1 TREATMENT OF SUCH AS OSTEOARTHITIS, RHEUMATOID ARTHRITIS, PREVENTION OR ARREST OF TUMOR GROWTH AND METASTASIS, CORNEAL ULCERATION, LACK OF CORNEAL HEALING, MACULAR DEGENERATION, PERIODONTAL DISEASE, GINGIVITIS THE PROCTER & GAMBLE COMPANY 2002-10-15 US disclosed
US-6150370-A 1,3-DINITROCYCLIC COMPOUND TREATS NUMEROUS DISEASES CAUSED BY UNDESIRED METALLOPROTEASE ACTIVITY, SUCH AS TUMOR METASTASIS, OSTEOARTHRITIS, RHEUMATOID ARTHRITIS, SKIN INFLAMMATION, ULCERATIONS, AND PERIODONTITIS THE PROCTER & GAMBLE COMPANY (US) 2000-11-21 US disclosed