SCHEMBL4119121

SCHEMBL4119121

CNC(OC(=O)/C=C/C(=O)O)c1cc(-c2cccnc2F)c(S(=O)(=O)c2cccc(OC)n2)s1

nearest known ligand 0.33

Predicted protein targets (top 1)

geneUniProtsupporting neighboursconfidence
NFE2L2 Q16236 2/20 0.33

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
SCHEMBL3646705 0.89 KDM4E (0.32)
SCHEMBL4126014 0.86 NAMPT (0.34) NFE2L2
SCHEMBL3651800 0.83 NAMPT (0.35)
Fumaric Acid SCHEMBL4119118 0.83 NFE2L2 (0.35) NFE2L2
Fumaric Acid SCHEMBL4119125 0.83 NFE2L2 (0.35) NFE2L2
SCHEMBL4130273 0.83 FEN1 (0.33)
SCHEMBL4135456 0.82 NAMPT (0.33)
SCHEMBL4132145 0.81 HCAR2 (0.32)
SCHEMBL3655995 0.75 NFE2L2 (0.41) NFE2L2
SCHEMBL4132156 0.75 KAT6A (0.42) NFE2L2

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
EP-2190822-B1 5-MEMBERED HETEROCYCLIC COMPOUNDS AS PROTON PUMP INHIBITORS TAKEDA PHARMACEUTICAL (JP) 2014-12-31 EP disclosed
US-20090156642-A1 5-Membered heterocyclic compound TAKEDA PHARMACEUTICAL COMPANY LIMITED (JP) 2009-06-18 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-20090156642-A1 5-Membered heterocyclic compound CEL, PGA5, COG5 NFE2L2 2670/4885

“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.