SCHEMBL940853

SCHEMBL940853

O=C1NCCc2c1[nH]c1cc(Br)ccc21

nearest known ligand 0.65

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 3/20 0.65
HPGD P15428 2/20 0.65
HTT P42858 2/20 0.65
MEN1 O00255 1/20 0.65
CYP1A2 P05177 1/20 0.65
CYP2C19 P33261 1/20 0.65
KMT2A Q03164 1/20 0.65
MAPT P10636 4/20 0.57
ALDH1A1 P00352 3/20 0.57
LMNA P02545 3/20 0.57
MTNR1A P48039 1/20 0.53
MTNR1B P49286 1/20 0.53
NCOA1 Q15788 2/20 0.52
NCOA3 Q9Y6Q9 2/20 0.52
TDP1 Q9NUW8 1/20 0.52
PRKD1 Q15139 1/20 0.48
MAPK1 P28482 2/20 0.48
GSK3B P49841 2/20 0.47
CDK5 Q00535 2/20 0.47
CCNB2 O95067 1/20 0.47

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
SCHEMBL5263677 0.88 MAPT (0.69) KDM4EHPGDHTTMEN1CYP1A2
SCHEMBL29855719 0.88 MAPT (0.69) KDM4EHPGDHTTMEN1CYP1A2
SCHEMBL14259277 0.82 PRKD1 (0.66) KDM4EHPGDHTTMEN1CYP1A2
SCHEMBL797563 0.79 KDM4E (1.00) KDM4EHPGDHTTMEN1CYP1A2
SCHEMBL4903858 0.78 KDM4E (0.80) KDM4EHPGDHTTMEN1CYP1A2
SCHEMBL942473 0.78 KDM4E (0.60) KDM4EHPGDHTTMEN1CYP1A2
Hydrochloric Acid SCHEMBL4901475 0.77 KDM4E (0.78) KDM4EHPGDHTTMEN1CYP1A2
SCHEMBL1003250 0.77 LMNA (0.78) KDM4EHPGDMEN1CYP1A2KMT2A
SCHEMBL29452862 0.77 LMNA (0.78) KDM4EHPGDMEN1CYP1A2KMT2A
SCHEMBL16923037 0.77 KDM4E (0.62) KDM4EHPGDHTTMEN1CYP1A2

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 27 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20240002339-A1 THERAPEUTIC COMPOUNDS AND METHODS NATIONAL INSTITUTES OF HEALTH 2024-01-04 US disclosed
US-9822092-B2 ArylSulfonamide-based matrix metalloprotease inhibitors NOVARTIS AG (CH) 2017-11-21 US disclosed
US-9822092-B2 ArylSulfonamide-based matrix metalloprotease inhibitors NOVARTIS AG (CH) 2017-11-21 US disclosed
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-8975439-B2 Arylsulfonamide based matrix metalloprotease inhibitors NOVARTIS AG (CH) 2015-03-10 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-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-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-8222424-B2 Arylsulfonamide-based matrix metalloprotease inhibitors NOVARTIS AG (CH) 2012-07-17 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
US-20110014186-A1 ARYLSULFONAMIDE-BASED MATRIX METALLOPROTEASE INHIBITORS NOVARTIS AG (CH) 2011-01-20 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
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 (5 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-20240002339-A1 THERAPEUTIC COMPOUNDS AND METHODS CDK2, CDK1, CCNI KDM4E 1446/4885HPGD 3119/4885HTT 3525/4885
US-20110014186-A1 ARYLSULFONAMIDE-BASED MATRIX METALLOPROTEASE INHIBITORS MMP11, MMP10, MMP9 KDM4E 1013/4885HPGD 445/4885HTT 657/4885
US-20150045398-A1 ArylSulfonamide-Based Matrix Metalloprotease Inhibitors MMP11, MMP10, MMP9 KDM4E 1013/4885HPGD 445/4885HTT 657/4885
US-20120258954-A1 ArylSulfonamide Based Matrix Metalloprotease Inhibitors MMP11, MMP9, MMP10 KDM4E 943/4885HPGD 507/4885HTT 695/4885
US-20130096105-A1 ArylSulfonamide Based Matrix Metalloprotease Inhibitors MMP11, MMP9, MMP10 KDM4E 943/4885HPGD 507/4885HTT 695/4885

“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.