SCHEMBL49295

SCHEMBL49295

O=C(NO)[C@@H]1CCCC[C@H]1NS(=O)(=O)c1ccc(Oc2ccccc2)cc1

nearest known ligand 0.65

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
MMP2 P08253 12/20 0.65
MMP13 P45452 9/20 0.65
MMP9 P14780 10/20 0.61
MMP1 P03956 8/20 0.61
MMP14 P50281 7/20 0.61
MMP3 P08254 6/20 0.61
MMP7 P09237 3/20 0.61
ADAM17 P78536 3/20 0.60
ALDH1A1 P00352 3/20 0.52
THRB P10828 1/20 0.52
LMNA P02545 1/20 0.50
ADAMTS4 O75173 2/20 0.49
ADAMTS5 Q9UNA0 2/20 0.49
MEP1B Q16820 1/20 0.49
FNTA P49354 1/20 0.48
FNTB P49356 1/20 0.48
NPSR1 Q6W5P4 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
SCHEMBL48854 1.00 MMP2 (0.65) MMP2MMP13MMP9MMP1MMP14
SCHEMBL49294 1.00 MMP2 (0.65) MMP2MMP13MMP9MMP1MMP14
SCHEMBL4382194 1.00 MMP2 (0.65) MMP2MMP13MMP9MMP1MMP14
SCHEMBL4383081 1.00 MMP2 (0.65) MMP2MMP13MMP9MMP1MMP14
SCHEMBL48622 0.89 MMP2 (0.69) MMP2MMP13MMP9MMP1MMP14
SCHEMBL48620 0.89 MMP2 (0.69) MMP2MMP13MMP9MMP1MMP14
SCHEMBL48636 0.89 MMP2 (0.69) MMP2MMP13MMP9MMP1MMP14
SCHEMBL48621 0.89 MMP2 (0.69) MMP2MMP13MMP9MMP1MMP14
SCHEMBL48635 0.89 MMP2 (0.69) MMP2MMP13MMP9MMP1MMP14
SCHEMBL4385516 0.86 MMP2 (0.59) MMP2MMP13MMP9MMP1MMP14

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-8129406-B2 Nonpeptide inhibitors of matrix metalloproteinases SOUTHERN RESEARCH INSTITUTE (US) 2012-03-06 US disclosed
EP-1735274-B1 NONPEPTIDE INHIBITORS OF MATRIX METALLOPROTEINASES SOUTHERN RES INST (US) 2009-11-25 EP disclosed
US-20080312329-A1 Nonpeptide Inhibitors of Matrix Metalloproteinases SOUTHERN RESEARCH INSTITUTE (US) 2008-12-18 US 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-20080312329-A1 Nonpeptide Inhibitors of Matrix Metalloproteinases MMP1, MMP3, MMP10 MMP2 11/4885MMP13 4/4885MMP9 7/4885

“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.