SCHEMBL1872005

SCHEMBL1872005

CC(C)(C)CS(=O)(=O)N(CCc1ccc(I)cc1)C(=O)O

nearest known ligand 0.38

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
RCE1 Q9Y256 1/20 0.35
MMP3 P08254 1/20 0.34
HTR2A P28223 1/20 0.34
HTR2C P28335 1/20 0.34
SLC6A4 P31645 1/20 0.34
SIGMAR1 Q99720 1/20 0.33
MEN1 O00255 2/20 0.32
KMT2A Q03164 2/20 0.32
HTT P42858 1/20 0.32
L3MBTL1 Q9Y468 1/20 0.32
PYCR1 P32322 1/20 0.32
CA12 O43570 1/20 0.32
CA1 P00915 1/20 0.32
CA2 P00918 1/20 0.32
CA4 P22748 1/20 0.32
ESRRG P62508 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
SCHEMBL2718186 0.82 RCE1 (0.43) RCE1MMP3HTR2AHTR2CSLC6A4
SCHEMBL1872003 0.74 ALDH1A1 (0.35) RCE1L3MBTL1CA12CA1CA2
SCHEMBL11898599 0.73 MEN1 (0.46) RCE1SIGMAR1MEN1KMT2AHTT
SCHEMBL28028361 0.71 RCE1 (0.47) RCE1MEN1KMT2ACA12CA1
SCHEMBL28255833 0.68 HSP90AA1 (0.50) RCE1MMP3MEN1KMT2ACA12
SCHEMBL27857424 0.66 CA1 (0.38) SIGMAR1MEN1KMT2ACA1CA2
SCHEMBL4420650 0.65 MEN1 (0.46) HTR2AHTR2CSLC6A4SIGMAR1MEN1
SCHEMBL230197 0.65 CTSK (0.36) SIGMAR1MEN1KMT2AHTTL3MBTL1
SCHEMBL23931825 0.64 MEN1 (0.50) MEN1KMT2AHTTL3MBTL1PYCR1
SCHEMBL6540918 0.64 HDAC1 (0.51) RCE1MEN1KMT2AL3MBTL1CA12

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
US-20140323502-A1 HETEROCYCLIC SULFONAMIDES, USES AND PHARMACEUTICAL COMPOSITIONS THEREOF BIOGEN MA INC. 2014-10-30 US disclosed
US-20120322823-A1 HETEROCYCLIC SULFONAMIDES, USES AND PHARMACEUTICAL COMPOSITIONS THEREOF PFIZER INC. 2012-12-20 US disclosed
US-8278457-B2 Heterocyclic sulfonamides, uses and pharmaceutical compositions thereof PFIZER INC. (US) 2012-10-02 US disclosed
US-20110105533-A1 Heterocyclic Sulfonamides, Uses and Pharmaceutical Compositions Thereof PFIZER INC. 2011-05-05 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 (3 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-20110105533-A1 Heterocyclic Sulfonamides, Uses and Pharmaceutical Compositions Thereof STS, SULT2A1, SULT1A1 RCE1 1770/4885MMP3 3858/4885HTR2A 1626/4885
US-20120322823-A1 HETEROCYCLIC SULFONAMIDES, USES AND PHARMACEUTICAL COMPOSITIONS THEREOF STS, SULT2A1, SULT1A1 RCE1 1770/4885MMP3 3858/4885HTR2A 1626/4885
US-20140323502-A1 HETEROCYCLIC SULFONAMIDES, USES AND PHARMACEUTICAL COMPOSITIONS THEREOF STS, SULT2A1, SULT1A1 RCE1 1770/4885MMP3 3858/4885HTR2A 1626/4885

“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.