SCHEMBL6324192

SCHEMBL6324192

CCCCCN(C(C)O)S(=O)(=O)c1ccc(OC)cc1

nearest known ligand 0.53

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
CNR2 P34972 1/20 0.53
KEAP1 Q14145 2/20 0.49
NFE2L2 Q16236 1/20 0.49
MMP9 P14780 5/20 0.47
MMP2 P08253 3/20 0.47
CA1 P00915 1/20 0.47
CA2 P00918 1/20 0.47
CA9 Q16790 1/20 0.47
HSD17B10 Q99714 1/20 0.47
BMP1 P13497 4/20 0.46
MMP13 P45452 6/20 0.46
MMP1 P03956 3/20 0.46
MMP8 P22894 2/20 0.46
MMP7 P09237 1/20 0.46
MMP12 P39900 1/20 0.46
ADAM17 P78536 2/20 0.45
TAS2R14 Q9NYV8 2/20 0.44
MMP3 P08254 1/20 0.44

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
SCHEMBL6323749 0.83 KEAP1 (0.48) CNR2KEAP1NFE2L2MMP9MMP2
SCHEMBL6323745 0.83 KEAP1 (0.48) CNR2KEAP1NFE2L2MMP9MMP2
SCHEMBL6323497 0.80 MMP13 (0.48) CNR2KEAP1NFE2L2MMP9MMP2
SCHEMBL6323494 0.80 MMP13 (0.48) CNR2KEAP1NFE2L2MMP9MMP2
SCHEMBL6323753 0.78 CNR2 (0.53) CNR2KEAP1MMP9MMP2BMP1
SCHEMBL13979922 0.78 CNR2 (0.61) CNR2KEAP1CA2CA9BMP1
SCHEMBL6324195 0.78 SMN1; SMN2 (0.65) CNR2KEAP1NFE2L2MMP9MMP2
SCHEMBL6325862 0.77 BMP1 (0.63) CNR2MMP9MMP2CA1CA2
SCHEMBL6324383 0.76 MMP3 (0.50) MMP9MMP2CA1CA2CA9
SCHEMBL29028430 0.76 CNR2 (0.56) CNR2KEAP1NFE2L2MMP9MMP2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20050014840-A1 Thiol sulfonamide metalloprotease inhibitors PHARMACIA CORPORATION 2005-01-20 US disclosed
US-6747027-B1 SELECTIVELY INHIBITS IN VITRO ACTIVITY OF HUMAN MATRIX METALLOPROTEASE-13 OVER IN VITRO ACTIVITY OF HUMAN MATRIX METALLOPROTEASE-1 PHARMACIA CORPORATION 2004-06-08 US disclosed
EP-0939629-A4 THIOL SULFONAMIDE METALLOPROTEASE INHIBITORS MONSANTO CO (US) 2002-07-17 EP disclosed
EP-0939629-A1 THIOL SULFONAMIDE METALLOPROTEASE INHIBITORS MONSANTO COMPANY (US) 1999-09-08 EP disclosed
WO-1998003166-A1 THIOL SULFONAMIDE METALLOPROTEASE INHIBITORS MONSANTO COMPANY (US) 1998-01-29 WO disclosed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (1 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.

PatentTitleText reads most aboutPredicted target · text-rank
US-20050014840-A1 Thiol sulfonamide metalloprotease inhibitors MMP12, MMP13, MMP3 CNR2 4079/4885KEAP1 1604/4885NFE2L2 2938/4885

“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.