SCHEMBL6033113

SCHEMBL6033113

NC(CS(=O)(=O)O)c1ccc(Br)cc1

nearest known ligand 0.42

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
GABBR2 O75899 1/20 0.42
GABBR1 Q9UBS5 1/20 0.42
DPP4 P27487 1/20 0.39
CA2 P00918 4/20 0.38
CA1 P00915 2/20 0.38
HTR2A P28223 1/20 0.37
PLCG1 P19174 1/20 0.36
CYP1A2 P05177 1/20 0.36
ALOX5 P09917 1/20 0.36
F2 P00734 1/20 0.35
PRSS1 P07477 1/20 0.35
PRSS2 P07478 1/20 0.35
PRSS3 P35030 1/20 0.35
SLC1A3 P43003 1/20 0.35
SLC1A2 P43004 1/20 0.35
SLC1A1 P43005 1/20 0.35
CA9 Q16790 2/20 0.34
OGG1 O15527 1/20 0.34
CA12 O43570 1/20 0.34

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
SCHEMBL6034394 0.81 GABBR2 (0.42) GABBR2GABBR1DPP4F2PRSS1
SCHEMBL6032624 0.81 GABBR2 (0.64) GABBR2GABBR1CA2CA1CYP1A2
SCHEMBL6033150 0.81 GABBR2 (0.42) GABBR2GABBR1CA2CA1ALOX5
SCHEMBL2486785 0.80 GBA1 (0.49) DPP4F2
SCHEMBL27721990 0.80 GBA1 (0.49) DPP4F2
SCHEMBL27662674 0.79 GABBR2 (0.45) GABBR2GABBR1CA2CA1CA9
SCHEMBL6034125 0.79 GBA1 (0.48) GABBR2GABBR1CA2CA1CA9
SCHEMBL28775527 0.77 CYP2C19 (0.40) GABBR2GABBR1CA2CA1HTR2A
SCHEMBL18489359 0.77 CYP1A2 (0.40) GABBR2GABBR1CA2CA1CYP1A2
SCHEMBL28329064 0.77 CYP1A2 (0.40) GABBR2GABBR1CA2CA1CYP1A2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-1882375-A treatment of amyloid-and epileptogenesis-related diseases NEUROCHEM INTERNAT LTD (CH) 2006-12-20 CN disclosed
EP-1635909-A2 TREATMENT OF AMYLOID- AND EPILEPTOGENESIS-ASSOCIATED DISEASES Neurochem (International) Limited (CH) 2006-03-22 EP disclosed
US-20050038000-A1 Methods and compositions for the treatment of amyloid-and epileptogenesis-associated diseases BELLUS HEALTH (INTERNATIONAL) LIMITED (CH) 2005-02-17 US disclosed
WO-2005000406-A2 TREATMENT OF AMYLOID- AND EPILEPTOGENESIS-ASSOCIATED DISEASES NEUROCHEM (INTERNATIONAL) LIMITED (CH) 2005-01-06 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 (1 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-20050038000-A1 Methods and compositions for the treatment of amyloid-and epileptogenesis-associated diseases APP, PSEN1, PSEN2 GABBR2 203/4885GABBR1 144/4885DPP4 2604/4885

“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.