SCHEMBL6732440

SCHEMBL6732440

COc1ccc(-c2ccc(S(=O)(=O)N[C@@H](C(=O)O)[C@H](Sc3nccn3C)c3ccccc3)cc2)cc1

nearest known ligand 0.53

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
MMP13 P45452 9/20 0.53
MMP2 P08253 8/20 0.53
MMP9 P14780 6/20 0.53
MMP3 P08254 6/20 0.53
MMP1 P03956 4/20 0.53
MMP7 P09237 2/20 0.53
MMP8 P22894 2/20 0.53
ADAMTS4 O75173 9/20 0.48
SLC1A3 P43003 1/20 0.47
SLC1A2 P43004 1/20 0.47
SLC1A1 P43005 1/20 0.47

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
SCHEMBL7387102 0.83 MMP2 (0.64) MMP13MMP2MMP9MMP3MMP1
SCHEMBL6733789 0.83 MMP2 (0.64) MMP13MMP2MMP9MMP3MMP1
SCHEMBL6768375 0.83 MMP2 (0.64) MMP13MMP2MMP9MMP3MMP1
SCHEMBL6736571 0.82 MMP2 (0.53) MMP13MMP2MMP9MMP3MMP1
SCHEMBL7391332 0.81 MMP13 (0.54) MMP13MMP2MMP9MMP3MMP1
SCHEMBL6737736 0.81 MMP13 (0.54) MMP13MMP2MMP9MMP3MMP1
SCHEMBL6733081 0.81 MMP13 (0.54) MMP13MMP2MMP9MMP3MMP1
SCHEMBL6736584 0.81 MMP2 (0.67) MMP13MMP2MMP9MMP3MMP1
SCHEMBL6738347 0.81 MMP2 (0.67) MMP13MMP2MMP9MMP3MMP1
SCHEMBL6742257 0.79 MMP13 (0.58) MMP13MMP2MMP9MMP3MMP1

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-20040142975-A1 Beta disubstituted metalloprotease inhibitors THE PROCTER &GAMBLE COMPANY 2004-07-22 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-20040142975-A1 Beta disubstituted metalloprotease inhibitors ADAM17, ADAM9, SI MMP13 57/4885MMP2 13/4885MMP9 7/4885

“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.