SCHEMBL7254697

SCHEMBL7254697

CC(C)(C)OC(=O)N1CCC(C(NS(=O)(=O)c2ccc(Oc3ccccc3)cc2)C(=O)NO)CC1

nearest known ligand 0.66

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
MMP13 P45452 15/20 0.66
MMP1 P03956 10/20 0.66
MMP3 P08254 8/20 0.66
MMP9 P14780 8/20 0.66
MMP8 P22894 7/20 0.66
MMP7 P09237 7/20 0.66
MMP2 P08253 6/20 0.66
ADAMTS7 Q9UKP4 4/20 0.61
ADAMTS5 Q9UNA0 4/20 0.61
ADAMTS4 O75173 2/20 0.54
ADAM17 P78536 2/20 0.54
ADAMTS1 Q9UHI8 2/20 0.54
STS P08842 1/20 0.51

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
SCHEMBL7256569 0.92 MMP13 (0.78) MMP13MMP1MMP3MMP9MMP8
SCHEMBL1770698 0.87 MMP13 (0.58) MMP13MMP1MMP3MMP9MMP8
SCHEMBL7950245 0.87 MMP13 (0.58) MMP13MMP1MMP3MMP9MMP8
SCHEMBL7350049 0.82 MMP13 (0.94) MMP13MMP1MMP3MMP9MMP8
SCHEMBL7347138 0.82 MMP13 (0.94) MMP13MMP1MMP3MMP9MMP8
SCHEMBL7249879 0.79 MMP13 (1.00) MMP13MMP1MMP3MMP9MMP8
SCHEMBL7350181 0.79 MMP13 (0.72) MMP13MMP1MMP3MMP9MMP8
SCHEMBL7358009 0.79 MMP13 (0.72) MMP13MMP1MMP3MMP9MMP8
SCHEMBL7254724 0.79 MMP13 (0.81) MMP13MMP1MMP3MMP9MMP8
SCHEMBL6290994 0.77 MMP13 (0.86) MMP13MMP1MMP3MMP9MMP8

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20030171400-A1 Heterocyclic side chain containing metalloprotease inhibitors PROCTER & GAMBLE COMPANY, THE 2003-09-11 US claimed

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-20030171400-A1 Heterocyclic side chain containing metalloprotease inhibitors SERPINB1, ADAM17, TMPRSS15 MMP13 70/4885MMP1 28/4885MMP3 14/4885

“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.