SCHEMBL11973669

SCHEMBL11973669

O=[N+]([O-])c1cc(Cl)ccc1S(=O)(=O)Nc1cccc2ccc(Cl)nc12

nearest known ligand 0.59

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
▸ RELA Q04206 8/20 0.59
▸ NFKBIA P25963 7/20 0.58
▸ SLC40A1 Q9NP59 10/20 0.58
▸ MEN1 O00255 2/20 0.58
▸ OPRK1 P41145 2/20 0.58
▸ KMT2A Q03164 2/20 0.58
▸ TDP1 Q9NUW8 2/20 0.58
▸ AGTR1 P30556 1/20 0.58
▸ MMP2 P08253 1/20 0.56
▸ MDM4 O15151 1/20 0.55
▸ MDM2 Q00987 1/20 0.55
▸ KIF18A Q8NI77 1/20 0.45

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
SCHEMBL11973574 0.87 RELA (0.75) RELANFKBIASLC40A1MEN1OPRK1
SCHEMBL11972893 0.87 SLC40A1 (0.77) RELANFKBIASLC40A1MEN1OPRK1
SCHEMBL11973716 0.81 SLC40A1 (0.60) RELANFKBIASLC40A1MEN1KMT2A
SCHEMBL11973249 0.74 RELA (1.00) RELANFKBIASLC40A1MEN1OPRK1
SCHEMBL11973293 0.74 SLC40A1 (0.59) RELANFKBIASLC40A1MEN1OPRK1
SCHEMBL11972939 0.74 RELA (1.00) RELANFKBIASLC40A1MEN1OPRK1
SCHEMBL11973893 0.73 SLC40A1 (1.00) RELANFKBIASLC40A1MEN1OPRK1
SCHEMBL11973667 0.73 RELA (1.00) RELANFKBIASLC40A1MEN1OPRK1
SCHEMBL10569884 0.73 IDH1 (0.56) MEN1KMT2AKIF18A
SCHEMBL30854820 0.72 SLC40A1 (0.68) RELANFKBIASLC40A1MEN1KMT2A

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
EP-2675526-B1 NOVEL SULFONAMINOQUINOLINE HEPCIDIN ANTAGONISTS VIFOR (INTERNATIONAL) AG (CH) 2017-02-01 — — EP disclosed
US-9102688-B2 Sulfonaminoquinoline hepcidin antagonists VIFOR (INTERNATIONAL) AG (CH) 2015-08-11 — — US disclosed
US-20140364424-A1 Novel Sulfonaminoquinoline Hepcidin Antagonists VIFOR (INTERNATIONAL) AG (CH) 2014-12-11 — — US disclosed
US-20120214803-A1 Novel Sulfonaminoquinoline Hepcidin Antagonists VIFOR (INTERNATIONAL) AG (CH) 2012-08-23 — — 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 (2 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-20120214803-A1 Novel Sulfonaminoquinoline Hepcidin Antagonists HAMP, SLC40A1, FTH1 RELA 1102/4885NFKBIA 277/4885SLC40A1 2/4885
US-20140364424-A1 Novel Sulfonaminoquinoline Hepcidin Antagonists HAMP, SLC40A1, FTH1 RELA 1102/4885NFKBIA 277/4885SLC40A1 2/4885

“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.

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