SCHEMBL939644

SCHEMBL939644

CC(C)(C)[Si](C)(C)OCCOc1ccc(Br)cc1.O=C(c1ccc(OCCO)cc1)c1ccc(Cl)c(S(=O)(=O)NC(CO)Oc2ccc(Br)cc2)c1

nearest known ligand 0.37

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
LSS P48449 7/20 0.37
GAA P10253 1/20 0.34
KDM4E B2RXH2 1/20 0.33
MEN1 O00255 3/20 0.33
KMT2A Q03164 3/20 0.33
LMNA P02545 2/20 0.33
GPR55 Q9Y2T6 1/20 0.33
L3MBTL1 Q9Y468 1/20 0.33
HTT P42858 3/20 0.33
MAPT P10636 2/20 0.33
SMN1; SMN2 Q16637 2/20 0.32
ALDH1A1 P00352 1/20 0.32
HPGD P15428 1/20 0.32

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
SCHEMBL940344 0.81 MMP2 (0.44) LSSLMNAL3MBTL1
SCHEMBL940798 0.76 MMP2 (0.48)
SCHEMBL941210 0.68 MMP2 (0.55) GAASMN1; SMN2
SCHEMBL2474081 0.67 ALDH1A1 (0.54) KDM4EMEN1KMT2ALMNAMAPT
SCHEMBL25279717 0.66 GAA (0.72) LSSGAAMEN1KMT2ALMNA
SCHEMBL15959250 0.66 GSTO1 (0.49) KDM4EMEN1KMT2ALMNAL3MBTL1
SCHEMBL24604970 0.66 NPC1 (0.48) GAAMEN1KMT2ALMNAL3MBTL1
SCHEMBL23877854 0.66 PPARA (0.60) GAALMNAL3MBTL1HTTMAPT
SCHEMBL7746323 0.65 PPARA (0.52) GAAKMT2ALMNAL3MBTL1MAPT
SCHEMBL10455732 0.64 MMP2 (0.53) KDM4ELMNAHTTMAPT

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 LSS 1111/4885GAA 116/4885KDM4E 1013/4885
US-20150045398-A1 ArylSulfonamide-Based Matrix Metalloprotease Inhibitors MMP11, MMP10, MMP9 LSS 1111/4885GAA 116/4885KDM4E 1013/4885
US-20120258954-A1 ArylSulfonamide Based Matrix Metalloprotease Inhibitors MMP11, MMP9, MMP10 LSS 1030/4885GAA 113/4885KDM4E 943/4885
US-20130096105-A1 ArylSulfonamide Based Matrix Metalloprotease Inhibitors MMP11, MMP9, MMP10 LSS 1030/4885GAA 113/4885KDM4E 943/4885

“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.