SCHEMBL941899

SCHEMBL941899

Brc1ccc(N2CCC(Cc3ccccc3)CC2)cc1

nearest known ligand 0.79

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
SLC6A2 P23975 5/20 0.79
SLC6A4 P31645 5/20 0.79
TSHR P16473 2/20 0.55
CCR3 P51677 2/20 0.54
ATM Q13315 1/20 0.52
ALDH1A1 P00352 1/20 0.51
LMNA P02545 1/20 0.51
MAPT P10636 1/20 0.51
HTT P42858 1/20 0.51
SMN1; SMN2 Q16637 1/20 0.51
BRCA1 P38398 1/20 0.50
PRMT3 O60678 1/20 0.50
CARM1 Q86X55 1/20 0.50
PRMT6 Q96LA8 1/20 0.50
PRMT1 Q99873 1/20 0.50
PRMT8 Q9NR22 1/20 0.50

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
SCHEMBL7241082 0.88 SLC6A2 (0.71) SLC6A2SLC6A4TSHRCCR3ALDH1A1
SCHEMBL6427944 0.84 MEN1 (0.61) SLC6A2SLC6A4TSHRCCR3ALDH1A1
SCHEMBL3540368 0.81 SLC6A2 (0.63) SLC6A2SLC6A4TSHRCCR3ALDH1A1
SCHEMBL13673491 0.81 SLC6A2 (0.56) SLC6A2SLC6A4TSHRCCR3ALDH1A1
SCHEMBL2952169 0.80 MEN1 (0.65) SLC6A2SLC6A4ALDH1A1MAPT
SCHEMBL2776292 0.80 SLC6A2 (0.55) SLC6A2SLC6A4TSHRCCR3LMNA
SCHEMBL7850831 0.80 HRH3 (0.57) SLC6A2SLC6A4TSHRCCR3CARM1
SCHEMBL5889215 0.80 ALDH1A1 (0.58) SLC6A2SLC6A4TSHRALDH1A1LMNA
SCHEMBL3323867 0.78 SMN1; SMN2 (0.54) SLC6A2SLC6A4TSHRCCR3ATM
SCHEMBL6428994 0.78 GAA (0.70) SLC6A2SLC6A4ALDH1A1MAPTHTT

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 12 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
CN-102036953-A Arylsulfonamide-based matrix metalloprotease inhibitors NOVARTIS AG 2011-04-27 CN 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 SLC6A2 1417/4885SLC6A4 1223/4885TSHR 2274/4885
US-20150045398-A1 ArylSulfonamide-Based Matrix Metalloprotease Inhibitors MMP11, MMP10, MMP9 SLC6A2 1417/4885SLC6A4 1223/4885TSHR 2274/4885
US-20120258954-A1 ArylSulfonamide Based Matrix Metalloprotease Inhibitors MMP11, MMP9, MMP10 SLC6A2 1574/4885SLC6A4 1281/4885TSHR 2169/4885
US-20130096105-A1 ArylSulfonamide Based Matrix Metalloprotease Inhibitors MMP11, MMP9, MMP10 SLC6A2 1574/4885SLC6A4 1281/4885TSHR 2169/4885

“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.