SCHEMBL4500848

SCHEMBL4500848

NS(=O)(=O)c1cc(S(=O)(=O)N(c2cccc(Br)c2)c2cccc(Br)c2)c2cc(O)ccc2c1

nearest known ligand 0.40

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PTGES O14684 1/20 0.37
TRPV1 Q8NER1 1/20 0.37
ESR1 P03372 1/20 0.35
CA2 P00918 6/20 0.34
CA9 Q16790 6/20 0.34
CA1 P00915 5/20 0.34
CA7 P43166 2/20 0.34
CA4 P22748 1/20 0.34
CA12 O43570 5/20 0.33
GLO1 Q04760 2/20 0.33
CA14 Q9ULX7 1/20 0.33
NPC1 O15118 1/20 0.33
RAB9A P51151 1/20 0.33
MPL P40238 1/20 0.32
LMNA P02545 1/20 0.32
ALPL P05186 1/20 0.32
ALPI P09923 1/20 0.32
ALPG P10696 1/20 0.32
DNMT1 P26358 1/20 0.32
MCL1 Q07820 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
SCHEMBL4494785 0.87 ESR1 (0.49) PTGESESR1CA2CA9CA1
SCHEMBL4497601 0.86 RORC (0.41) PTGESTRPV1ESR1CA2CA9
SCHEMBL4497044 0.86 PTGES (0.45) PTGESTRPV1ESR1CA2CA1
SCHEMBL4511797 0.86 PTGES (0.37) PTGESTRPV1ESR1CA2CA9
SCHEMBL4505955 0.86 CA2 (0.41) CA2CA9CA1CA7CA4
SCHEMBL4494085 0.84 PARP1 (0.40) PTGESESR1CA2CA9CA1
SCHEMBL4503529 0.81 ESR1 (0.41) PTGESESR1CA2CA9CA1
SCHEMBL4506803 0.81 PTGES (0.38) PTGESTRPV1ESR1CA2CA9
SCHEMBL4512914 0.80 PTGES (0.39) PTGESTRPV1ESR1CA2CA9
SCHEMBL4508410 0.80 PTGES (0.41) PTGESESR1CA2CA9CA1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20090234014-A1 Naphthalene-Disulfonamides Useful for the Treatment of Inflammation BIOLIPOX AB (SE) 2009-09-17 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-20090234014-A1 Naphthalene-Disulfonamides Useful for the Treatment of Inflammation AREG, PRSS12, CXCL8 PTGES 41/4885TRPV1 1914/4885ESR1 1760/4885

“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.