SCHEMBL939796

SCHEMBL939796

COCCCc1cc(-c2c[nH]c3cc(C(=O)c4ccc(Cl)c(S(N)(=O)=O)c4)ccc23)ccn1

nearest known ligand 0.61

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MMP2 P08253 3/20 0.61
IMPDH2 P12268 2/20 0.40
NPC1 O15118 1/20 0.38
RAB9A P51151 1/20 0.38
CA1 P00915 8/20 0.38
CA2 P00918 8/20 0.38
CA12 O43570 6/20 0.38
CA6 P23280 6/20 0.38
CA7 P43166 6/20 0.38
CA13 Q8N1Q1 6/20 0.38
CA9 Q16790 5/20 0.38
CA3 P07451 4/20 0.38
CA4 P22748 4/20 0.38
CA5A P35218 4/20 0.38
CA14 Q9ULX7 4/20 0.38
CA5B Q9Y2D0 4/20 0.38
DYRK1A Q13627 2/20 0.38
GSK3B P49841 1/20 0.38
ASH1L Q9NR48 1/20 0.37
TDO2 P48775 1/20 0.36

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
SCHEMBL940037 0.88 MMP2 (0.67) MMP2IMPDH2CA1CA2CA12
SCHEMBL941240 0.86 TDO2 (0.44) MMP2IMPDH2CA1CA2CA12
SCHEMBL939794 0.83 MMP2 (0.70) MMP2IMPDH2CA1CA2CA12
SCHEMBL940311 0.83 MMP2 (0.73) MMP2IMPDH2CA1CA2CA12
SCHEMBL940447 0.83 MMP2 (0.56) MMP2CA1CA2CA12CA6
SCHEMBL939510 0.81 MMP2 (0.60) MMP2IMPDH2CA1CA2CA12
SCHEMBL28005056 0.81 ASH1L (0.41) MMP2IMPDH2DYRK1AGSK3BASH1L
SCHEMBL941261 0.80 MMP2 (0.80) MMP2IMPDH2CA1CA2CA12
SCHEMBL940425 0.79 MMP2 (0.67) MMP2IMPDH2CA1CA2CA12
SCHEMBL940327 0.78 MMP2 (0.76) MMP2IMPDH2CA2DYRK1AGSK3B

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 11 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
EP-2268612-B1 ARYLSULFONAMIDE-BASED MATRIX METALLOPROTEASE INHIBITORS NOVARTIS AG (CH) 2014-08-20 EP 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
EP-2268612-A1 ARYLSULFONAMIDE-BASED MATRIX METALLOPROTEASE INHIBITORS Novartis AG (CH) 2011-01-05 EP disclosed
WO-2009118292-A1 ARYLSULFONAMIDE-BASED MATRIX METALLOPROTEASE INHIBITORS NOVARTIS AG (CH) 2009-10-01 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 (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 18/4885IMPDH2 1704/4885NPC1 1157/4885
US-20150045398-A1 ArylSulfonamide-Based Matrix Metalloprotease Inhibitors MMP11, MMP10, MMP9 MMP2 18/4885IMPDH2 1704/4885NPC1 1157/4885
US-20120258954-A1 ArylSulfonamide Based Matrix Metalloprotease Inhibitors MMP11, MMP9, MMP10 MMP2 19/4885IMPDH2 1807/4885NPC1 1236/4885
US-20130096105-A1 ArylSulfonamide Based Matrix Metalloprotease Inhibitors MMP11, MMP9, MMP10 MMP2 19/4885IMPDH2 1807/4885NPC1 1236/4885

“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.