SCHEMBL2680439

SCHEMBL2680439

COC(=O)C(CNCS(=O)(=O)c1ccc(OCc2ccccc2)cc1)N1CCCCC1

nearest known ligand 0.66

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
ADAM17 P78536 4/20 0.66
ADAM33 Q9BZ11 8/20 0.60
HTT P42858 1/20 0.46
HRH3 Q9Y5N1 1/20 0.45
MMP1 P03956 1/20 0.45
MMP3 P08254 1/20 0.45
SMN1; SMN2 Q16637 2/20 0.43
NPC1 O15118 1/20 0.43
RAB9A P51151 1/20 0.43
DPP7 Q9UHL4 1/20 0.43
LMNA P02545 1/20 0.43
EGFR P00533 1/20 0.43
KDM4E B2RXH2 1/20 0.43
ALDH1A1 P00352 1/20 0.43
NPY1R P25929 1/20 0.43

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
SCHEMBL2682037 0.91 ADAM17 (0.66) ADAM17ADAM33HTTHRH3MMP1
SCHEMBL997829 0.91 ADAM17 (0.66) ADAM17ADAM33HTTHRH3MMP1
SCHEMBL27977404 0.90 ADAM17 (0.82) ADAM17ADAM33MMP1MMP3
SCHEMBL27853845 0.90 ADAM17 (0.82) ADAM17ADAM33MMP1MMP3
SCHEMBL2682836 0.88 ADAM17 (0.80) ADAM17ADAM33MMP1MMP3
SCHEMBL2682839 0.88 ADAM17 (0.80) ADAM17ADAM33MMP1MMP3
SCHEMBL2680625 0.87 ADAM33 (0.79) ADAM17ADAM33HTTMMP1MMP3
SCHEMBL2680630 0.87 ADAM33 (0.79) ADAM17ADAM33HTTMMP1MMP3
SCHEMBL2680791 0.86 ADAM33 (0.78) ADAM17ADAM33HTTMMP1MMP3
SCHEMBL2680798 0.86 ADAM33 (0.78) ADAM17ADAM33HTTMMP1MMP3

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-8772478-B2 Benzenesulfonamide compounds, method for synthesizing same, and use thereof in medicine as well as in cosmetics GALDERMA RESEARCH & DEVELOPMENT (FR) 2014-07-08 US disclosed
US-20120116072-A1 NOVEL BENZENESULFONAMIDE COMPOUNDS, METHOD FOR SYNTHESIZING SAME, AND USE THEREOF IN MEDICINE AS WELL AS IN COSMETICS GALDERMA RESEARCH & DEVELOPEMENT (FR) 2012-05-10 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-20120116072-A1 NOVEL BENZENESULFONAMIDE COMPOUNDS, METHOD FOR SYNTHESIZING SAME, AND USE THEREOF IN MEDICINE AS WELL AS IN COSMETICS TYR, ARSA, STS ADAM17 3458/4885ADAM33 3905/4885HTT 1527/4885

“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.