SCHEMBL6290459

SCHEMBL6290459

COCCOC(=O)N1CCC(C(C(=O)NO)N(C)S(=O)(=O)c2ccc(-c3ccc(OC)cc3)cc2)CC1

nearest known ligand 0.82

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
MMP13 P45452 18/20 0.82
MMP3 P08254 17/20 0.82
MMP8 P22894 16/20 0.82
MMP2 P08253 15/20 0.82
MMP1 P03956 15/20 0.82
MMP9 P14780 14/20 0.82
MMP7 P09237 12/20 0.82
ADAMTS7 Q9UKP4 2/20 0.53
ADAMTS5 Q9UNA0 2/20 0.53

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
SCHEMBL6293753 0.91 MMP8 (0.73) MMP13MMP3MMP8MMP2MMP1
SCHEMBL6290451 0.90 MMP13 (1.00) MMP13MMP3MMP8MMP2MMP1
SCHEMBL6360526 0.86 MMP13 (0.61) MMP13MMP3MMP8MMP2MMP1
SCHEMBL6291155 0.86 MMP2 (0.73) MMP13MMP3MMP8MMP2MMP1
SCHEMBL7255799 0.82 MMP3 (0.83) MMP13MMP3MMP8MMP2MMP1
SCHEMBL6294208 0.82 MMP13 (0.61) MMP13MMP3MMP8MMP2MMP1
SCHEMBL6294166 0.82 MMP13 (0.88) MMP13MMP3MMP8MMP2MMP1
SCHEMBL6291161 0.82 MMP13 (1.00) MMP13MMP3MMP8MMP2MMP1
SCHEMBL6809689 0.80 MMP13 (0.56) MMP13MMP3MMP8MMP2MMP1
SCHEMBL6289775 0.80 MMP13 (0.89) MMP13MMP3MMP8MMP2MMP1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-6949545-B2 Heterocyclic side chain containing, n-substituted metalloprotease inhibitors THE PROCTER & GAMBLE COMPANY (US) 2005-09-27 US claimed
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 38/4885MMP3 13/4885MMP8 37/4885

“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.