SCHEMBL3274555

SCHEMBL3274555

COC(=O)CC[C@@]1(O)CC[C@H]2[C@@H]3[C@H](C(=O)OC)CC4=CC(=O)CC[C@]4(C)[C@]34O[C@@H]4C[C@@]21C

nearest known ligand 0.68

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
NR3C1 P04150 7/20 0.68
PGR P06401 6/20 0.68
NR3C2 P08235 3/20 0.68
AR P10275 3/20 0.68
ALDH1A1 P00352 1/20 0.48
MAPK1 P28482 1/20 0.48
TDP1 Q9NUW8 3/20 0.38
KMT2A Q03164 2/20 0.38
MEN1 O00255 1/20 0.38
LMNA P02545 1/20 0.35
PDE4D Q08499 1/20 0.35
KDM4E B2RXH2 1/20 0.34
CYP17A1 P05093 1/20 0.33
HIF1A Q16665 2/20 0.33
CYP3A4 P08684 2/20 0.33
USP2 O75604 1/20 0.33
SMN1; SMN2 Q16637 1/20 0.33
HRH1 P35367 1/20 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
SCHEMBL17603224 1.00 NR3C1 (0.68) NR3C1PGRNR3C2ARALDH1A1
SCHEMBL3279049 1.00 NR3C1 (0.68) NR3C1PGRNR3C2ARALDH1A1
SCHEMBL6406521 1.00 NR3C1 (0.68) NR3C1PGRNR3C2ARALDH1A1
SCHEMBL14437808 1.00 NR3C1 (0.68) NR3C1PGRNR3C2ARALDH1A1
SCHEMBL10942668 0.94 NR3C1 (0.60) NR3C1PGRNR3C2ARALDH1A1
SCHEMBL10942681 0.94 NR3C1 (0.60) NR3C1PGRNR3C2ARALDH1A1
SCHEMBL3275715 0.93 NR3C1 (0.68) NR3C1PGRNR3C2ARALDH1A1
SCHEMBL6408534 0.93 NR3C1 (0.68) NR3C1PGRNR3C2ARALDH1A1
SCHEMBL4982380 0.93 NR3C1 (0.68) NR3C1PGRNR3C2ARALDH1A1
SCHEMBL4979442 0.93 NR3C1 (0.68) NR3C1PGRNR3C2ARALDH1A1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20100087412-A1 Micronized Eplerenone Compositions PFIZER INC 2010-04-08 US disclosed
US-20070196471-A1 Micronized Eplerenone Compositions THOSAR SHILPA S 2007-08-23 US disclosed
US-7157101-B2 Micronized eplerenone compositions G.D. SEARLE, LLC (US) 2007-01-02 US disclosed
US-20050192259-A1 Aldosterone antagonist compositions for release during aldosterone acrophase PHARMACIA CORPORATION 2005-09-01 US disclosed
EP-1527782-A1 Nanoparticulate eplerenone compositions Pharmacia Corporation (US) 2005-05-04 EP disclosed
EP-1175220-B1 NANOPARTICULATE EPLERENONE COMPOSITIONS PHARMACIA CORP (US) 2005-04-27 EP disclosed
US-6863902-B2 Mixture of methyl hydrogen 9,11 alpha-epoxy-17 alpha-hydroxy-3-oxopregn-4-ene-7-alpha, 21-dicarboxylate, gamma-lactone and carriers administered as aldosterone receptor antagonists, for prophylaxis of cardiovascular disorders G. D. SEARLE & CO. (US) 2005-03-08 US disclosed
US-20040192661-A1 Micronized eplerenone compositions G. D. SEARLE & CO. 2004-09-30 US disclosed
US-20030215518-A1 Immediate release eplerenone compositions THOSAR SHILPA S (US) 2003-11-20 US disclosed
US-20030212053-A1 Nanoparticulate eplerenone compositions THOSAR SHILPA S (US) 2003-11-13 US disclosed
EP-1135139-B1 MICRONIZED EPLERENONE COMPOSITIONS SEARLE & CO (US) 2003-09-10 EP disclosed
US-6592902-B2 Aldosterone receptor blockers THOSAR SHILPA S (US) 2003-07-15 US disclosed
US-6558707-B1 Micronized particles in carrier such as a purified, micro-crystalline or alkylated cellulose G. D. SEARLE & CO. 2003-05-06 US disclosed
US-6534093-B1 Immediate release eplerenone compositions G.D. SEARLE & CO. 2003-03-18 US disclosed
US-6495165-B1 PARTICLES OF PREGN-4-ENE-7,21-DICARBOXYLIC ACID, 9,11-EPOXY-17-HYDROXY-3-OXO-,GAMMA-LACTONE, METHYL ESTER(7,11,17-ALPHA) AND CARRIERS ADMINISTERED AS ALDOSTERONE RECEPTOR ANTAGONIST FOR PROPHYLAXIS OF CARDIOVASCULAR AND LIVER DISORDERS G.D. SEARLE & CO. 2002-12-17 US disclosed
US-20020136775-A1 Controlled release eplerenone compositions THOSAR SHILPA S (US) 2002-09-26 US disclosed
US-20020132001-A1 Aldosterone antagonist composition for release during aldosterone acrophase PHARMACIA CORPORATION 2002-09-19 US disclosed
US-6410054-B1 Immediate release eplerenone compositions G. D. SEARLE & CO. 2002-06-25 US disclosed
US-20020006919-A1 Nanoparticulate eplerenone compositions THOSAR SHILPA S (US) 2002-01-17 US disclosed
US-4559332-A 20-Spiroxanes and analogues having an open ring E, processes for their manufacture, and pharmaceutical preparations thereof CIBA GEIGY CORPORATION (US) 1985-12-17 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 (9 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-20100087412-A1 Micronized Eplerenone Compositions NR3C2, MC2R, PTGER1 NR3C1 28/4885PGR 232/4885NR3C2 1/4885
US-20030212053-A1 Nanoparticulate eplerenone compositions NR3C2, PTGER1, MC2R NR3C1 16/4885PGR 527/4885NR3C2 1/4885
US-20020006919-A1 Nanoparticulate eplerenone compositions NR3C2, PTGER1, MC2R NR3C1 16/4885PGR 527/4885NR3C2 1/4885
US-20030215518-A1 Immediate release eplerenone compositions MC2R, NR3C2, ADRB1 NR3C1 19/4885PGR 218/4885NR3C2 2/4885
US-20020132001-A1 Aldosterone antagonist composition for release during aldosterone acrophase NR3C2, MC2R, HSD11B2 NR3C1 19/4885PGR 718/4885NR3C2 1/4885
US-20020136775-A1 Controlled release eplerenone compositions MC2R, NR3C2, ADRB1 NR3C1 24/4885PGR 167/4885NR3C2 2/4885
US-20050192259-A1 Aldosterone antagonist compositions for release during aldosterone acrophase NR3C2, HSD11B1, HSD11B2 NR3C1 21/4885PGR 728/4885NR3C2 1/4885
US-20070196471-A1 Micronized Eplerenone Compositions NR3C2, MC2R, PTGER1 NR3C1 28/4885PGR 232/4885NR3C2 1/4885
US-20040192661-A1 Micronized eplerenone compositions NR3C2, MC2R, PTGER1 NR3C1 28/4885PGR 232/4885NR3C2 1/4885

“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.