SCHEMBL940344

SCHEMBL940344

CC(C)(C)[Si](C)(C)OCCOc1ccc(Br)cc1.CC(C)(C)[Si](C)(C)OCCOc1ccc(C(=O)c2ccc(Cl)c(S(N)(=O)=O)c2)cc1

nearest known ligand 0.44

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
MMP2 P08253 2/20 0.44
CA1 P00915 13/20 0.40
CA2 P00918 13/20 0.40
CA12 O43570 9/20 0.40
CA7 P43166 8/20 0.40
CA13 Q8N1Q1 8/20 0.40
CA6 P23280 7/20 0.40
CA9 Q16790 6/20 0.40
LMNA P02545 1/20 0.40
L3MBTL1 Q9Y468 1/20 0.40
CA14 Q9ULX7 4/20 0.39
CA3 P07451 3/20 0.39
CA4 P22748 3/20 0.39
CA5A P35218 3/20 0.39
CA5B Q9Y2D0 3/20 0.39
STAT3 P40763 1/20 0.39
LSS P48449 1/20 0.39
NPSR1 Q6W5P4 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
SCHEMBL940798 0.95 MMP2 (0.48) MMP2CA1CA2CA12CA7
SCHEMBL10455732 0.83 MMP2 (0.53) MMP2CA1CA2CA12CA7
SCHEMBL939644 0.81 LSS (0.37) LMNAL3MBTL1LSS
SCHEMBL941153 0.80 MMP2 (0.54) MMP2CA1CA2CA12CA7
SCHEMBL940508 0.79 MMP2 (0.64) MMP2CA1CA2CA12CA7
SCHEMBL941210 0.79 MMP2 (0.55) MMP2CA1CA2CA12CA7
SCHEMBL941157 0.78 MMP2 (0.52) MMP2CA1CA2CA12CA7
SCHEMBL939758 0.77 TSHR (0.51) MMP2CA1CA2CA12CA7
SCHEMBL941770 0.77 MAPK1 (0.51) MMP2CA1CA2CA12CA7
SCHEMBL2474081 0.75 ALDH1A1 (0.54) LMNA

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-9822092-B2 ArylSulfonamide-based matrix metalloprotease inhibitors NOVARTIS AG (CH) 2017-11-21 US disclosed
US-8975439-B2 Arylsulfonamide based matrix metalloprotease inhibitors NOVARTIS AG (CH) 2015-03-10 US disclosed
US-20150045398-A1 ArylSulfonamide-Based Matrix Metalloprotease Inhibitors NOVARTIS AG (CH) 2015-02-12 US disclosed
US-20130096105-A1 ArylSulfonamide Based Matrix Metalloprotease Inhibitors NOVARTIS AG (CH) 2013-04-18 US disclosed
US-8362063-B2 Arylsulfonamide based matrix metalloprotease inhibitors NOVARTIS AG (CH) 2013-01-29 US disclosed
US-20120258954-A1 ArylSulfonamide Based Matrix Metalloprotease Inhibitors NOVARTIS AG (CH) 2012-10-11 US disclosed
US-8222424-B2 Arylsulfonamide-based matrix metalloprotease inhibitors NOVARTIS AG (CH) 2012-07-17 US disclosed
US-20110014186-A1 ARYLSULFONAMIDE-BASED MATRIX METALLOPROTEASE INHIBITORS NOVARTIS AG (CH) 2011-01-20 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 (4 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-20110014186-A1 ARYLSULFONAMIDE-BASED MATRIX METALLOPROTEASE INHIBITORS MMP11, MMP10, MMP9 MMP2 18/4885CA1 2747/4885CA2 1123/4885
US-20150045398-A1 ArylSulfonamide-Based Matrix Metalloprotease Inhibitors MMP11, MMP10, MMP9 MMP2 18/4885CA1 2747/4885CA2 1123/4885
US-20120258954-A1 ArylSulfonamide Based Matrix Metalloprotease Inhibitors MMP11, MMP9, MMP10 MMP2 19/4885CA1 2740/4885CA2 1073/4885
US-20130096105-A1 ArylSulfonamide Based Matrix Metalloprotease Inhibitors MMP11, MMP9, MMP10 MMP2 19/4885CA1 2740/4885CA2 1073/4885

“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.