SCHEMBL4180132

SCHEMBL4180132

O=C(c1csc(NS(=O)(=O)c2ccccc2)n1)N1CCOC(COc2cccc(Cl)c2)C1

nearest known ligand 0.44

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
HTR1A P08908 2/20 0.44
HTR7 P34969 2/20 0.44
KDM1A O60341 9/20 0.43
MAOA P21397 6/20 0.43
ACLY P53396 1/20 0.41
PDK1 Q15118 1/20 0.41
GRM2 Q14416 1/20 0.39

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
SCHEMBL4173661 0.88 PDK1 (0.40) ACLYPDK1
SCHEMBL4184547 0.82 DRD4 (0.41) PDK1
SCHEMBL3162711 0.82 SCN9A (0.48)
SCHEMBL4176042 0.77 ALDH1A1 (0.47)
SCHEMBL4178403 0.76 TRPC3 (0.41) KDM1A
SCHEMBL4175075 0.75 GAA (0.43)
SCHEMBL3163505 0.74 ALDH1A1 (0.43) HTR1AHTR7KDM1AMAOA
SCHEMBL4173760 0.73 HCRTR1 (0.46)
SCHEMBL4172610 0.72 SCD5 (0.41) KDM1A
SCHEMBL4178167 0.72 TRPC3 (0.54)

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8357711-B2 Heterocyclic sulfonamides as inhibitors of ion channels PFIZER LIMITED (GB) 2013-01-22 US disclosed
US-20090143358-A1 INHIBITORS OF ION CHANNELS ICAGEN, INC. (US) 2009-06-04 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 (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-20090143358-A1 INHIBITORS OF ION CHANNELS TRPV1, TRPV5, TRPA1 HTR1A 1665/4885HTR7 1667/4885KDM1A 2129/4885

“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.