SCHEMBL4297311

SCHEMBL4297311

Cc1cc(F)ccc1-n1nc(C(F)(F)F)cc1-c1ccc2c(c1)NC(=O)CS2

nearest known ligand 0.69

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
▸ NR3C2 P08235 14/20 0.69
▸ NR3C1 P04150 6/20 0.69
▸ PGR P06401 5/20 0.69
▸ AR P10275 1/20 0.62
▸ PTGS2 P35354 2/20 0.39
▸ PTGS1 P23219 1/20 0.39
▸ SLC5A1 P13866 1/20 0.38
▸ GAA P10253 1/20 0.37

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
SCHEMBL4296023 0.85 NR3C2 (0.66) NR3C2NR3C1PGRPTGS2PTGS1
SCHEMBL4287116 0.84 NR3C2 (0.72) NR3C2NR3C1PGRARPTGS2
SCHEMBL4292036 0.81 NR3C2 (1.00) NR3C2NR3C1PGRAR
SCHEMBL4293879 0.79 NR3C2 (0.78) NR3C2NR3C1PGRAR
SCHEMBL4291579 0.78 NR3C2 (1.00) NR3C2NR3C1PGRARPTGS2
SCHEMBL4295689 0.77 NR3C2 (1.00) NR3C2NR3C1PGRAR
SCHEMBL4288530 0.76 NR3C2 (1.00) NR3C2NR3C1PGRARPTGS2
SCHEMBL4297574 0.76 NR3C2 (0.85) NR3C2NR3C1PGRARPTGS2
SCHEMBL4291050 0.76 NR3C2 (0.81) NR3C2NR3C1PGRARPTGS2
SCHEMBL4300312 0.74 NR3C2 (0.82) NR3C2NR3C1PGRARPTGS2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20090253687-A1 Fused Heterocyclic Compounds and Their Use as Mineralocorticoid Receptor Ligands TAKEDA PHARMACEUTICAL COMPANY LIMITED (JP) 2009-10-08 — — US disclosed
US-20090253687-A1 Fused Heterocyclic Compounds and Their Use as Mineralocorticoid Receptor Ligands TAKEDA PHARMACEUTICAL COMPANY LIMITED (JP) 2009-10-08 — — US disclosed
US-20090253687-A1 Fused Heterocyclic Compounds and Their Use as Mineralocorticoid Receptor Ligands TAKEDA PHARMACEUTICAL COMPANY LIMITED (JP) 2009-10-08 — — US disclosed
EP-1971596-A2 FUSED HETEROCYCLIC COMPOUNDS AND THEIR USE AS MINERALOCORTICOID RECEPTOR LIGANDS Takeda Pharmaceutical Company Limited (JP) 2008-09-24 — — EP disclosed
WO-2007077961-A2 FUSED HETEROCYCLIC COMPOUNDS AND THEIR USE AS MINERALOCORTICOID RECEPTOR LIGANDS TAKEDA PHARMACEUTICAL COMPANY LIMITED (JP) 2007-07-12 — — WO disclosed
WO-2007077961-A2 FUSED HETEROCYCLIC COMPOUNDS AND THEIR USE AS MINERALOCORTICOID RECEPTOR LIGANDS TAKEDA PHARMACEUTICAL COMPANY LIMITED (JP) 2007-07-12 — — WO 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-20090253687-A1 Fused Heterocyclic Compounds and Their Use as Mineralocorticoid Receptor Ligands NR3C2, NR3C1, MC2R NR3C2 1/4885NR3C1 2/4885PGR 408/4885

“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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