Eplerenone

Eplerenone

SCHEMBL18382990

COC(=O)C1CC2=CC(=O)CC[C@]2(C)[C@@]23O[C@@H]2C[C@@]2(C)[C@@H](CC[C@@]24CCC(=O)O4)[C@H]13

nearest known ligand 1.00 ✓ in ChEMBL — recovers established targets

Full drug profile on Sugi Atlas →

Known targets — ChEMBL curated mechanism

NR3C2

The experimentally established mechanism targets of Eplerenone. The predicted profile below is derived independently by chemical similarity — agreement is a validation signal, a miss is honest.

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ NR3C2 known ✓ P08235 3/20 1.00
▸ NR3C1 P04150 5/20 1.00
▸ PGR P06401 5/20 1.00
▸ AR P10275 4/20 1.00
▸ ALDH1A1 P00352 1/20 0.46
▸ MAPK1 P28482 1/20 0.46
▸ LMNA P02545 4/20 0.45
▸ CHRM2 P08172 3/20 0.45
▸ CYP3A4 P08684 2/20 0.45
▸ OPRK1 P41145 2/20 0.45
▸ ABCB11 O95342 2/20 0.45
▸ HTR2B P41595 2/20 0.45
▸ NFKB1 P19838 1/20 0.45
▸ HIF1A Q16665 1/20 0.45
▸ ESR1 P03372 1/20 0.45
▸ ABCB1 P08183 1/20 0.45
▸ CYP2C19 P33261 1/20 0.45
▸ ADRA1A P35348 1/20 0.45
▸ ESR2 Q92731 1/20 0.45
▸ SLC47A1 Q96FL8 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
Eplerenone SCHEMBL14567750 1.00 NR3C1 (1.00) NR3C1PGRARNR3C2ALDH1A1
Eplerenone SCHEMBL685681 1.00 NR3C1 (1.00) NR3C1PGRARNR3C2ALDH1A1
Eplerenone SCHEMBL564496 1.00 NR3C1 (1.00) NR3C1PGRARNR3C2ALDH1A1
Eplerenone SCHEMBL17993628 1.00 NR3C1 (1.00) NR3C1PGRARNR3C2ALDH1A1
Eplerenone SCHEMBL14571282 1.00 NR3C1 (1.00) NR3C1PGRARNR3C2ALDH1A1
Eplerenone SCHEMBL14284883 1.00 NR3C1 (1.00) NR3C1PGRARNR3C2ALDH1A1
Eplerenone SCHEMBL8175261 1.00 NR3C1 (1.00) NR3C1PGRARNR3C2ALDH1A1
Eplerenone SCHEMBL14565703 1.00 NR3C1 (1.00) NR3C1PGRARNR3C2ALDH1A1
Eplerenone SCHEMBL19887682 1.00 NR3C1 (1.00) NR3C1PGRARNR3C2ALDH1A1
Eplerenone SCHEMBL8445849 1.00 NR3C1 (1.00) NR3C1PGRARNR3C2ALDH1A1

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
US-20170015688-A1 SUBSTITUTED BISPHENYL BUTANOIC PHOSPHONIC ACID DERIVATIVES AS NEP INHIBITORS NOVARTIS AG (CH) 2017-01-19 — — US disclosed
US-20170015688-A1 SUBSTITUTED BISPHENYL BUTANOIC PHOSPHONIC ACID DERIVATIVES AS NEP INHIBITORS NOVARTIS AG (CH) 2017-01-19 — — 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-20170015688-A1 SUBSTITUTED BISPHENYL BUTANOIC PHOSPHONIC ACID DERIVATIVES AS NEP INHIBITORS MME, REN, ENPP1 NR3C2 231/4885NR3C1 769/4885PGR 2235/4885

“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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