SCHEMBL7082386

SCHEMBL7082386

COc1ccc(-c2ccc(S(=O)(=O)N[C@@H](C(=O)O)C3CCC(O)CC3)cc2)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 19/20 1.00
MMP2 P08253 17/20 1.00
MMP1 P03956 16/20 0.81
MMP7 P09237 14/20 0.81
MMP9 P14780 8/20 0.78
MMP8 P22894 8/20 0.78

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
SCHEMBL7256578 0.90 MMP13 (0.81) MMP13MMP3MMP2MMP1MMP7
SCHEMBL7249960 0.87 MMP13 (1.00) MMP13MMP3MMP2MMP1MMP7
SCHEMBL7256981 0.87 MMP13 (0.79) MMP13MMP3MMP2MMP1MMP7
SCHEMBL7245718 0.87 MMP13 (1.00) MMP13MMP3MMP2MMP1MMP7
SCHEMBL7239169 0.87 MMP13 (1.00) MMP13MMP3MMP2MMP1MMP7
SCHEMBL7456237 0.86 MMP13 (0.78) MMP13MMP3MMP2MMP1MMP7
SCHEMBL7251827 0.84 MMP13 (0.77) MMP13MMP3MMP2MMP1MMP7
SCHEMBL7250944 0.84 MMP13 (1.00) MMP13MMP3MMP2MMP1MMP7
SCHEMBL7078454 0.84 MMP2 (0.73) MMP13MMP3MMP2MMP1MMP7
SCHEMBL7252210 0.83 MMP13 (0.81) MMP13MMP3MMP2MMP1MMP7

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20030162778-A1 Carbocyclic side chain containing metalloprotease inhibitors THE PROCTER AND GAMBLE COMPANY 2003-08-28 US disclosed
US-20030144292-A1 Carbocyclic side chain containing, N-substituted metalloprotease inhibitors PROCTER & GAMBLE COMPANY, THE 2003-07-31 US disclosed
EP-1265887-A2 CARBOCYCLIC SIDE CHAIN CONTAINING METALLOPROTEASE INHIBITORS THE PROCTER & GAMBLE COMPANY (US) 2002-12-18 EP disclosed
WO-2001070682-A2 CARBOCYCLIC SIDE CHAIN CONTAINING METALLOPROTEASE INHIBITORS THE PROCTER & GAMBLE COMPANY (US) 2001-09-27 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 (2 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-20030162778-A1 Carbocyclic side chain containing metalloprotease inhibitors MMP2, CMA1, SERPINB1 MMP13 24/4885MMP3 6/4885MMP2 1/4885
US-20030144292-A1 Carbocyclic side chain containing, N-substituted metalloprotease inhibitors MMP2, MMP3, CMA1 MMP13 20/4885MMP3 2/4885MMP2 1/4885

“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.