SCHEMBL4323009

SCHEMBL4323009

COc1cccc(S(=O)(=O)N(CCC(C)C)[C@@H](C(=O)OCc2ccccc2)C(C)(C)C)c1

nearest known ligand 0.48

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
MMP2 P08253 6/20 0.48
MMP13 P45452 6/20 0.48
TAS2R14 Q9NYV8 5/20 0.45
PGR P06401 2/20 0.42
KEAP1 Q14145 1/20 0.42
NFE2L2 Q16236 1/20 0.42
CYP11B1 P15538 1/20 0.39
MMP3 P08254 2/20 0.39
MMP9 P14780 2/20 0.39
KDM4E B2RXH2 1/20 0.39
CACNA1H O95180 1/20 0.38

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
SCHEMBL4316551 0.89 TAS2R14 (0.45) TAS2R14PGRKEAP1NFE2L2CYP11B1
SCHEMBL4313198 0.88 TAS2R14 (0.44) TAS2R14PGRKEAP1NFE2L2KDM4E
SCHEMBL4310251 0.87 MMP2 (0.52) MMP2MMP13TAS2R14PGRKEAP1
SCHEMBL4310204 0.85 TAS2R14 (0.45) MMP2TAS2R14PGRKEAP1NFE2L2
SCHEMBL4313668 0.85 TAS2R14 (0.45) TAS2R14PGRKEAP1NFE2L2CYP11B1
SCHEMBL4318699 0.84 CYP11B1 (0.48) MMP2TAS2R14PGRKEAP1NFE2L2
SCHEMBL4318692 0.84 CYP11B1 (0.48) MMP2TAS2R14PGRKEAP1NFE2L2
SCHEMBL8231945 0.84 MMP2 (0.51) MMP2MMP13TAS2R14PGRKEAP1
SCHEMBL4316391 0.82 MMP2 (0.62) MMP2MMP13MMP9
SCHEMBL11948509 0.82 MMP2 (0.53) MMP2MMP13TAS2R14KEAP1NFE2L2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2001838-B1 SELECTIVE HYDROXAMATE BASED MMP INHIBITORS NOVARTIS AG (CH) 2014-03-12 EP disclosed
EP-2001838-B1 SELECTIVE HYDROXAMATE BASED MMP INHIBITORS NOVARTIS AG (CH) 2014-03-12 EP disclosed
EP-2597083-A2 Selective hydroxamate based MMP inhibitors Novartis AG (CH) 2013-05-29 EP disclosed
EP-2597083-A2 Selective hydroxamate based MMP inhibitors Novartis AG (CH) 2013-05-29 EP disclosed
US-8314148-B2 Selective hydroxamate based MMP inhibitors NOVARTIS AG (CH) 2012-11-20 US disclosed
US-8314148-B2 Selective hydroxamate based MMP inhibitors NOVARTIS AG (CH) 2012-11-20 US disclosed
US-8314148-B2 Selective hydroxamate based MMP inhibitors NOVARTIS AG (CH) 2012-11-20 US disclosed
US-20120225882-A1 SELECTIVE HYDROXAMATE BASED MMP INHIBITORS NOVARTIS AG (CH) 2012-09-06 US disclosed
US-20120225882-A1 SELECTIVE HYDROXAMATE BASED MMP INHIBITORS NOVARTIS AG (CH) 2012-09-06 US disclosed
US-20120225882-A1 SELECTIVE HYDROXAMATE BASED MMP INHIBITORS NOVARTIS AG (CH) 2012-09-06 US disclosed
US-8232427-B2 Selective hydroxamate based MMP inhibitors NOVARTIS AG (CH) 2012-07-31 US disclosed
US-8232427-B2 Selective hydroxamate based MMP inhibitors NOVARTIS AG (CH) 2012-07-31 US disclosed
US-8232427-B2 Selective hydroxamate based MMP inhibitors NOVARTIS AG (CH) 2012-07-31 US disclosed
US-20090318511-A1 SELECTIVE HYDROXAMATE BASED MMP INHIBITORS NOVARTIS AG (CH) 2009-12-24 US disclosed
US-20090318511-A1 SELECTIVE HYDROXAMATE BASED MMP INHIBITORS NOVARTIS AG (CH) 2009-12-24 US disclosed
US-20090318511-A1 SELECTIVE HYDROXAMATE BASED MMP INHIBITORS NOVARTIS AG (CH) 2009-12-24 US disclosed
EP-2001838-A2 SELECTIVE HYDROXAMATE BASED MMP INHIBITORS Novartis AG (CH) 2008-12-17 EP disclosed
WO-2007117981-A2 SELECTIVE HYDROXAMATE BASED MMP INHIBITORS NOVARTIS AG (CH) 2007-10-18 WO disclosed
WO-2007117981-A2 SELECTIVE HYDROXAMATE BASED MMP INHIBITORS NOVARTIS AG (CH) 2007-10-18 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-20090318511-A1 SELECTIVE HYDROXAMATE BASED MMP INHIBITORS MMP13, MMP11, MMP14 MMP2 15/4885MMP13 1/4885TAS2R14 2291/4885
US-20120225882-A1 SELECTIVE HYDROXAMATE BASED MMP INHIBITORS MMP13, MMP11, MMP14 MMP2 15/4885MMP13 1/4885TAS2R14 2291/4885

“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.