SCHEMBL7250041

SCHEMBL7250041

COC(=O)C(NS(=O)(=O)c1ccc(C#Cc2ccc(OC)cc2)cc1)C1CCN(C(=O)N2CCOCC2)CC1

nearest known ligand 0.73

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
MMP13 P45452 17/20 0.73
MMP3 P08254 16/20 0.73
MMP2 P08253 13/20 0.73
MMP1 P03956 12/20 0.73
MMP9 P14780 11/20 0.73
MMP7 P09237 11/20 0.73
MMP8 P22894 10/20 0.73
ADAMTS7 Q9UKP4 1/20 0.49
ADAMTS5 Q9UNA0 1/20 0.49
LMNA P02545 1/20 0.46

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
SCHEMBL7253917 0.93 MMP13 (0.84) MMP13MMP3MMP2MMP1MMP9
SCHEMBL6289713 0.92 MMP13 (0.86) MMP13MMP3MMP2MMP1MMP9
SCHEMBL7249949 0.85 MMP13 (0.66) MMP13MMP3MMP2MMP1MMP9
SCHEMBL7255895 0.84 MMP13 (1.00) MMP13MMP3MMP2MMP1MMP9
SCHEMBL7249791 0.83 MMP13 (0.83) MMP13MMP3MMP2MMP1MMP9
SCHEMBL6291093 0.79 MMP13 (0.66) MMP13MMP3MMP2MMP1MMP9
SCHEMBL7452602 0.79 MMP13 (0.74) MMP13MMP3MMP2MMP1MMP9
SCHEMBL7251923 0.78 MMP13 (0.53) MMP13MMP3MMP2MMP1MMP9
SCHEMBL7250745 0.76 MMP13 (0.76) MMP13MMP3MMP2MMP1MMP9
SCHEMBL6290994 0.75 MMP13 (0.86) 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 3 patents. 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 disclosed
EP-1265863-A1 HETEROCYCLIC SIDE CHAIN CONTAINING METALLOPROTEASE INHIBITORS THE PROCTER & GAMBLE COMPANY (US) 2002-12-18 EP disclosed
WO-2001070690-A1 HETEROCYCLIC 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 (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.