SCHEMBL7357288

SCHEMBL7357288

CCOC(=O)C(CC)(Cc1ccc(OCCC2CCCCN2)cc1)S(=O)(=O)c1ccc(OC)cc1

nearest known ligand 0.41

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
MMP9 P14780 11/20 0.41
MMP13 P45452 11/20 0.41
MMP1 P03956 10/20 0.41
CHEK2 O96017 1/20 0.37
ADAM17 P78536 1/20 0.35
LMNA P02545 1/20 0.35
TSHR P16473 1/20 0.35
HTT P42858 1/20 0.35
SMN1; SMN2 Q16637 1/20 0.35
ALDH1A1 P00352 1/20 0.35
FKBP1A P62942 1/20 0.35
KCNH2 Q12809 1/20 0.35

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
SCHEMBL7347280 0.94 MMP13 (0.42) MMP9MMP13MMP1CHEK2ADAM17
SCHEMBL7348654 0.91 MMP9 (0.43) MMP9MMP13MMP1CHEK2ADAM17
SCHEMBL7412135 0.90 MMP13 (0.42) MMP9MMP13MMP1ADAM17
SCHEMBL7349184 0.89 MMP1 (0.49) MMP9MMP13MMP1CHEK2ADAM17
SCHEMBL7348309 0.88 MMP1 (0.51) MMP9MMP13MMP1CHEK2ADAM17
SCHEMBL7409762 0.88 MMP13 (0.51) MMP9MMP13MMP1ADAM17
SCHEMBL7345984 0.86 MMP13 (0.44) MMP9MMP13MMP1CHEK2ADAM17
SCHEMBL7411808 0.82 MMP1 (0.46) MMP9MMP13MMP1CHEK2
SCHEMBL7416424 0.82 MMP13 (0.44) MMP9MMP13MMP1ADAM17
SCHEMBL7352386 0.82 MMP1 (0.52) MMP9MMP13MMP1CHEK2ADAM17

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-1054858-A1 N-HYDROXY-2-(ALKYL, ARYL, OR HETEROARYL SULFANYL, SULFINYL OR SULFONYL)-3-SUBSTITUTED-ALKYL, ARYL OR HETEROARYLAMIDES AS MATRIX METALLOPROTEINASE INHIBITORS American Cyanamid Company (US) 2000-11-29 EP disclosed
EP-0973512-A1 N-HYDROXY-2-(ALKYL, ARYL OR HETEROARYL SULFANYL, SULFINYL OR SULFONYL)-3-SUBSTITUTED ALKYL, ARYL OR HETEROARYLAMIDES AS MATRIX METALLOPROTEINASE INHIBITORS American Cyanamid Company (US) 2000-01-26 EP disclosed
EP-0970046-A1 N-HYDROXY-2-(ALKYL, ARYL, OR HETEROARYL SULFANYL, SULFINYL OR SULFONYL)-3-SUBSTITUTED ALKYL, ARYL OR HETEROARYLAMIDES AS MATRIX METALLOPROTEINASE INHIBITORS American Cyanamid Company (US) 2000-01-12 EP disclosed
WO-1999042436-A1 N-HYDROXY-2-(ALKYL, ARYL, OR HETEROARYL SULFANYL, SULFINYL OR SULFONYL)-3-SUBSTITUTED-ALKYL, ARYL OR HETEROARYLAMIDES AS MATRIX METALLOPROTEINASE INHIBITORS AMERICAN CYANAMID COMPANY (US) 1999-08-26 WO disclosed
WO-1998038163-A1 N-HYDROXY-2-(ALKYL, ARYL, OR HETEROARYL SULFANYL, SULFINYL OR SULFONYL)-3-SUBSTITUTED ALKYL, ARYL OR HETEROARYLAMIDES AS MATRIX METALLOPROTEINASE INHIBITORS AMERICAN CYANAMID COMPANY (US) 1998-09-03 WO disclosed
WO-1998037877-A1 N-HYDROXY-2-(ALKYL, ARYL OR HETEROARYL SULFANYL, SULFINYL OR SULFONYL)-3-SUBSTITUTED ALKYL, ARYL OR HETEROARYLAMIDES AS MATRIX METALLOPROTEINASE INHIBITORS AMERICAN CYANAMID COMPANY (US) 1998-09-03 WO disclosed