SCHEMBL7250053

SCHEMBL7250053

CCOC(=O)N1CCC(C(NS(=O)(=O)c2ccc(-c3ccc(OC)cc3)cc2)C(=O)O)CC1

nearest known ligand 1.00 ✓ in ChEMBL — recovers established targets

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
MMP13 P45452 20/20 1.00
MMP3 P08254 17/20 1.00
MMP2 P08253 15/20 1.00
MMP1 P03956 14/20 1.00
MMP9 P14780 14/20 1.00
MMP8 P22894 14/20 1.00
MMP7 P09237 12/20 1.00

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
SCHEMBL7250944 0.93 MMP13 (1.00) MMP13MMP3MMP2MMP1MMP9
SCHEMBL7251321 0.92 MMP3 (1.00) MMP13MMP3MMP2MMP1MMP9
SCHEMBL7250770 0.91 MMP13 (0.83) MMP13MMP3MMP2MMP1MMP9
SCHEMBL7250856 0.91 MMP13 (0.83) MMP13MMP3MMP2MMP1MMP9
SCHEMBL7251490 0.90 MMP13 (1.00) MMP13MMP3MMP2MMP1MMP9
SCHEMBL7251451 0.88 MMP13 (0.83) MMP13MMP3MMP2MMP1MMP9
SCHEMBL7249879 0.88 MMP13 (1.00) MMP13MMP3MMP2MMP1MMP9
SCHEMBL7255433 0.87 MMP13 (0.76) MMP13MMP3MMP2MMP1MMP9
SCHEMBL7252210 0.87 MMP13 (0.81) MMP13MMP3MMP2MMP1MMP9
SCHEMBL7250568 0.87 MMP13 (0.81) MMP13MMP3MMP2MMP1MMP9

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 70/4885MMP3 14/4885MMP2 5/4885

“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.