SCHEMBL7043145

SCHEMBL7043145

COc1ccc(-c2ccc(S(=O)(=O)N(Cc3cccnc3)C(C(=O)O)C3CCOCC3)cc2)cc1

nearest known ligand 0.72

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
MMP13 P45452 11/20 0.72
MMP8 P22894 5/20 0.72
MMP9 P14780 14/20 0.59
MMP2 P08253 7/20 0.59
ADAMTS4 O75173 1/20 0.54
MMP1 P03956 9/20 0.52
MMP3 P08254 3/20 0.52
MMP7 P09237 3/20 0.52
CXCR3 P49682 1/20 0.49
BMP1 P13497 1/20 0.47
ADAM17 P78536 5/20 0.47
ALDH1A1 P00352 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
SCHEMBL7046221 0.90 MMP13 (0.58) MMP13MMP8MMP9MMP2MMP1
SCHEMBL6293833 0.84 MMP13 (1.00) MMP13MMP8MMP9MMP2ADAMTS4
SCHEMBL6294163 0.81 MMP13 (0.62) MMP13MMP8MMP9MMP2MMP1
SCHEMBL7045752 0.80 MMP13 (0.71) MMP13MMP8MMP9MMP2MMP1
SCHEMBL7342446 0.79 MMP9 (0.66) MMP13MMP8MMP9MMP2MMP1
SCHEMBL7342443 0.79 MMP9 (0.66) MMP13MMP8MMP9MMP2MMP1
SCHEMBL7077456 0.79 MMP13 (0.54) MMP13MMP8MMP9MMP2MMP1
Hydrochloric Acid SCHEMBL7350103 0.79 MMP9 (0.65) MMP13MMP8MMP9MMP2MMP1
Hydrochloric Acid SCHEMBL7350105 0.79 MMP9 (0.65) MMP13MMP8MMP9MMP2MMP1
Hydrochloric Acid SCHEMBL7413637 0.78 MMP9 (0.64) MMP13MMP8MMP9MMP2MMP1

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-20030139414-A1 Heterocyclic side chain containing, n-substituted metalloprotease inhibitors THE PROCTER & GAMBLE COMPANY 2003-07-24 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-20030139414-A1 Heterocyclic side chain containing, n-substituted metalloprotease inhibitors MME, MMP2, MMP9 MMP13 38/4885MMP8 37/4885MMP9 3/4885

“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.