SCHEMBL16285219

SCHEMBL16285219

COC(=O)c1ccc2c(c1)-c1ccc3cccnc3c1N[S+]2[O-]

nearest known ligand 0.62

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ SLC40A1 Q9NP59 14/20 0.62
▸ ALOX15 P16050 2/20 0.46
▸ HTT P42858 2/20 0.46
▸ EGLN1 Q9GZT9 1/20 0.43
▸ NFKBIA P25963 3/20 0.42
▸ RELA Q04206 3/20 0.42
▸ ALDH1A1 P00352 3/20 0.41
▸ MAPT P10636 3/20 0.39
▸ KDM4E B2RXH2 2/20 0.38
▸ LMNA P02545 2/20 0.38
▸ NPSR1 Q6W5P4 2/20 0.38
▸ L3MBTL1 Q9Y468 2/20 0.38
▸ MEN1 O00255 1/20 0.38
▸ TSHR P16473 1/20 0.38
▸ OPRK1 P41145 1/20 0.38
▸ KMT2A Q03164 1/20 0.38
▸ SMN1; SMN2 Q16637 1/20 0.38
▸ HSD17B10 Q99714 1/20 0.38
▸ TDP1 Q9NUW8 1/20 0.38
▸ GAA P10253 1/20 0.38

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
SCHEMBL16285217 0.87 SLC40A1 (0.58) SLC40A1ALOX15HTTNFKBIARELA
SCHEMBL16285218 0.85 SLC40A1 (0.45) SLC40A1ALOX15HTTNFKBIARELA
SCHEMBL11973458 0.78 SLC40A1 (0.66) SLC40A1ALOX15HTTEGLN1NFKBIA
SCHEMBL11995663 0.77 SLC40A1 (1.00) SLC40A1ALOX15HTTNFKBIARELA
SCHEMBL18434668 0.75 SLC40A1 (0.56) SLC40A1ALOX15HTTEGLN1NFKBIA
SCHEMBL18434454 0.72 SLC40A1 (0.53) SLC40A1ALOX15HTTNFKBIARELA
SCHEMBL11995745 0.70 SLC40A1 (0.60) SLC40A1ALDH1A1KDM4E
SCHEMBL18434463 0.70 SLC40A1 (0.67) SLC40A1KDM4EMEN1KMT2A
SCHEMBL16502605 0.69 ALOX15 (0.56) SLC40A1ALOX15HTTEGLN1ALDH1A1
SCHEMBL27994689 0.69 PSMD14 (0.64) SLC40A1ALOX15HTTEGLN1ALDH1A1

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-9102688-B2 Sulfonaminoquinoline hepcidin antagonists VIFOR (INTERNATIONAL) AG (CH) 2015-08-11 — — US 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-20140364424-A1 Novel Sulfonaminoquinoline Hepcidin Antagonists VIFOR (INTERNATIONAL) AG (CH) 2014-12-11 — — 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-20140364424-A1 Novel Sulfonaminoquinoline Hepcidin Antagonists HAMP, SLC40A1, FTH1 SLC40A1 2/4885ALOX15 1134/4885HTT 1327/4885

“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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