SCHEMBL12649188

SCHEMBL12649188

CC(C)[C@@H](NS(=O)(=O)c1ccc2ccccc2c1)C(=O)NO

nearest known ligand 0.67

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
MMP1 P03956 6/20 0.67
MMP9 P14780 6/20 0.67
MMP13 P45452 6/20 0.67
MMP2 P08253 5/20 0.67
MMP3 P08254 5/20 0.67
MMP7 P09237 5/20 0.67
ADAM17 P78536 2/20 0.61
SLC1A3 P43003 1/20 0.59
SLC1A2 P43004 1/20 0.59
SLC1A1 P43005 1/20 0.59
HDAC8 Q9BY41 1/20 0.54
HDAC6 Q9UBN7 1/20 0.54
LARS1 Q9P2J5 1/20 0.52

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
SCHEMBL1770811 1.00 MMP1 (0.67) MMP1MMP9MMP13MMP2MMP3
SCHEMBL14025842 0.91 ADAM17 (0.60) MMP1MMP9MMP13MMP2MMP3
SCHEMBL4925808 0.91 ADAM17 (0.60) MMP1MMP9MMP13MMP2MMP3
SCHEMBL1832585 0.88 MMP13 (0.59) MMP1MMP9MMP13MMP2MMP3
SCHEMBL6979084 0.86 SLC1A3 (0.73) MMP1MMP9MMP13MMP2MMP3
SCHEMBL8529829 0.86 SLC1A3 (0.73) MMP1MMP9MMP13MMP2MMP3
SCHEMBL7405654 0.85 SLC1A3 (0.60) MMP1MMP9MMP13MMP2MMP3
SCHEMBL1828557 0.85 MMP13 (0.56) MMP1MMP9MMP13MMP2MMP3
SCHEMBL7380443 0.83 MMP13 (0.77) MMP1MMP9MMP13MMP2MMP3
SCHEMBL7380440 0.83 MMP13 (0.77) MMP1MMP9MMP13MMP2MMP3

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-8841291-B2 Selective hydroxamic acid based MMP-12 and MMP-13 inhibitors NOVARTIS AG (CH) 2014-09-23 US disclosed
US-20140031399-A1 SELECTIVE HYDROXAMIC ACID BASED MMP-12 AND MMP-13 INHIBITORS NOVARTIS AG (CH) 2014-01-30 US disclosed
US-20110112076-A1 SELECTIVE HYDROXAMIC ACID BASED MMP-12 AND MMP-13 INHIBITORS NOVARTIS AG (CH) 2011-05-12 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 (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-20110112076-A1 SELECTIVE HYDROXAMIC ACID BASED MMP-12 AND MMP-13 INHIBITORS MMP13, MMP11, MMP14 MMP1 16/4885MMP9 10/4885MMP13 1/4885
US-20140031399-A1 SELECTIVE HYDROXAMIC ACID BASED MMP-12 AND MMP-13 INHIBITORS MMP13, MMP11, MMP14 MMP1 16/4885MMP9 9/4885MMP13 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.