SCHEMBL7695753

SCHEMBL7695753

COc1ccc(S(=O)(=O)N(CC(=O)O)C(C(=O)OCc2ccccc2)C(C)C)cc1

nearest known ligand 0.58

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
MMP2 P08253 7/20 0.58
MMP9 P14780 7/20 0.58
MMP8 P22894 6/20 0.58
MMP13 P45452 4/20 0.58
MMP1 P03956 2/20 0.58
MMP14 P50281 2/20 0.58
MMP3 P08254 1/20 0.58
MMP16 P51512 1/20 0.58
ADAM17 P78536 1/20 0.58
KEAP1 Q14145 9/20 0.54
NFE2L2 Q16236 6/20 0.53
TAS2R14 Q9NYV8 2/20 0.49
DAGLA Q9Y4D2 1/20 0.49
PTGES O14684 1/20 0.49
TAS2R8 Q9NYW2 1/20 0.49
CXCR3 P49682 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
SCHEMBL7695749 1.00 MMP2 (0.58) MMP2MMP9MMP8MMP13MMP1
SCHEMBL7446097 0.91 KEAP1 (0.49) MMP2MMP9MMP8MMP13MMP1
SCHEMBL8016350 0.89 BMP1 (0.51) MMP2MMP9MMP8MMP13MMP1
SCHEMBL8521366 0.86 MMP2 (0.60) MMP2MMP9MMP8MMP13MMP1
SCHEMBL6389641 0.83 TAS2R14 (0.58) MMP2MMP9MMP8MMP13TAS2R14
SCHEMBL6389646 0.83 TAS2R14 (0.58) MMP2MMP9MMP8MMP13TAS2R14
SCHEMBL6391015 0.79 MMP2 (0.48) MMP2MMP9MMP8MMP13KEAP1
SCHEMBL6391009 0.79 MMP2 (0.48) MMP2MMP9MMP8MMP13KEAP1
SCHEMBL7091056 0.78 MMP2 (0.76) MMP2MMP9MMP8MMP13KEAP1
SCHEMBL7091051 0.78 MMP2 (0.76) MMP2MMP9MMP8MMP13KEAP1

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-6380219-B1 FOR THERAPY OF ARTHRITIS, CANCER, TISSUE ULCERATION, RESTENOSIS, PERIDONTAL DISEASE, EPIDERMOLYSIS BULLOSA, SCLERITIS AND OTHER DISEASES CHARACTERIZED BY MATRIX METALLOPROTEINASE ACTIVITY, SEPSIS, SEPTIC SHOCK PFIZER INC 2002-04-30 US disclosed
US-5863949-A Arylsulfonylamino hydroxamic acid derivatives PFIZER INC (US) 1999-01-26 US disclosed