SCHEMBL6928993

SCHEMBL6928993

CCOc1ccc(S(=O)(=O)C(C)(Cc2ccc(OC(C)N(CC)CC)cc2)C(=O)NO)cc1

nearest known ligand 0.69

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
MMP1 P03956 17/20 0.69
MMP13 P45452 17/20 0.69
MMP9 P14780 16/20 0.69
ADAM17 P78536 1/20 0.42

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
SCHEMBL6930711 0.91 MMP13 (0.67) MMP1MMP13MMP9ADAM17
SCHEMBL7133713 0.91 MMP1 (0.68) MMP1MMP13MMP9ADAM17
Diethylamine SCHEMBL6933694 0.83 MMP13 (0.74) MMP1MMP13MMP9ADAM17
SCHEMBL7133709 0.83 MMP1 (0.85) MMP1MMP13MMP9
SCHEMBL6928992 0.82 MMP1 (1.00) MMP1MMP13MMP9
SCHEMBL6933162 0.82 MMP13 (0.71) MMP1MMP13MMP9ADAM17
SCHEMBL6933406 0.82 MMP13 (0.65) MMP1MMP13MMP9ADAM17
SCHEMBL6929194 0.81 MMP13 (0.69) MMP1MMP13MMP9ADAM17
Diethylamine SCHEMBL6932200 0.80 MMP13 (0.71) MMP1MMP13MMP9ADAM17
SCHEMBL6929195 0.75 MMP13 (1.00) MMP1MMP13MMP9ADAM17

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0970046-B1 N-HYDROXY-2-(ALKYL, ARYL, OR HETEROARYL SULFANYL, SULFINYL OR SULFONYL)-3-SUBSTITUTED ALKYL, ARYL OR HETEROARYLAMIDES AS MATRIX METALLOPROTEINASE INHIBITORS WYETH CORP (US) 2003-12-10 EP claimed
US-6172057-B1 ANTIINFLAMMATORY AGENTS; ANTIARTHRITIC AGENTS; ANTITUMOR AGENTS AMERICAN CYANAMID COMPANY 2001-01-09 US claimed
EP-0970046-B1 N-HYDROXY-2-(ALKYL, ARYL, OR HETEROARYL SULFANYL, SULFINYL OR SULFONYL)-3-SUBSTITUTED ALKYL, ARYL OR HETEROARYLAMIDES AS MATRIX METALLOPROTEINASE INHIBITORS WYETH CORP (US) 2003-12-10 EP disclosed
US-6444704-B1 ANTIINFLAMMATORY AGENTS, ANTIARTHRITIC AGENTS, ANTITUMOR AGENTS AMERICAN HOME PRODUCTS CORPORATION 2002-09-03 US disclosed
US-6342508-B1 ENZYME INHIBITORS FOR PROTECTION OF CONNECTIVE TISSUES AMERICAN CYANAMID COMPANY 2002-01-29 US disclosed
US-6172057-B1 ANTIINFLAMMATORY AGENTS; ANTIARTHRITIC AGENTS; ANTITUMOR AGENTS AMERICAN CYANAMID COMPANY 2001-01-09 US disclosed