Deflazacort

Deflazacort

SCHEMBL4259541

CC(=O)OCC(=O)[C@@]12N=C(C)O[C@@H]1C[C@H]1[C@@H]3CCC4=CC(=O)C=C[C@]4(C)[C@H]3[C@@H](O)C[C@@]12C.CCO

nearest known ligand 0.95

Full drug profile on Sugi Atlas →

Known targets — ChEMBL curated mechanism

NR3C1

The experimentally established mechanism targets of Deflazacort. 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
NR3C1 known ✓ P04150 8/20 0.95
PGR P06401 7/20 0.95
HIF1A Q16665 5/20 0.62
CYP3A4 P08684 5/20 0.55
LMNA P02545 3/20 0.55
CYP2C9 P11712 2/20 0.55
HSD17B10 Q99714 2/20 0.55
ABCC3 O15438 1/20 0.55
ABCC4 O15439 1/20 0.55
ABCB11 O95342 1/20 0.55
IL5 P05113 1/20 0.55
NR3C2 P08235 1/20 0.55
AR P10275 1/20 0.55
CHRM1 P11229 1/20 0.55
MMP9 P14780 1/20 0.55
NFKB1 P19838 1/20 0.55
THPO P40225 1/20 0.55
SMN1; SMN2 Q16637 1/20 0.55
BLM P54132 1/20 0.55
PMP22 Q01453 1/20 0.55

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
Deflazacort SCHEMBL4019 0.98 NR3C1 (1.00) NR3C1PGRHIF1ACYP3A4LMNA
Deflazacort SCHEMBL24497637 0.98 NR3C1 (1.00) NR3C1PGRHIF1ACYP3A4LMNA
Deflazacort SCHEMBL4018 0.98 NR3C1 (1.00) NR3C1PGRHIF1ACYP3A4LMNA
Deflazacort SCHEMBL2598076 0.98 NR3C1 (1.00) NR3C1PGRHIF1ACYP3A4LMNA
Deflazacort SCHEMBL22502722 0.97 NR3C1 (0.98) NR3C1PGRHIF1ACYP3A4LMNA
Deflazacort SCHEMBL17941674 0.95 NR3C1 (0.94) NR3C1PGRHIF1ACYP3A4LMNA
Deflazacort SCHEMBL887173 0.91 NR3C1 (0.84) NR3C1PGRHIF1ACYP3A4LMNA
SCHEMBL13653579 0.90 NR3C1 (0.86) NR3C1PGRHIF1ACYP3A4LMNA
21-Desacetyldeflazacort SCHEMBL30754690 0.89 NR3C1 (0.81) NR3C1PGRHIF1ACYP3A4LMNA
SCHEMBL13653592 0.87 NR3C1 (0.80) NR3C1PGRHIF1ACYP3A4LMNA

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-101132766-A Tablet containing steroid hormone LOHMANN THERAPIE SYST LTS (DE) 2008-02-27 CN claimed
EP-1470227-B1 Method for selective introduction of a double bond in a steroid BAYER SCHERING PHARMA AG (DE) 2007-04-11 EP claimed
US-20060222708-A1 Wafer comprising steroid hormones BAYER INTELLECTUAL PROPERTY GMBH (DE) 2006-10-05 US claimed
US-20040091987-A1 Process for the overexpression of dehydrogenases SCHERING AG (DE) 2004-05-13 US claimed
CN-104983669-B tablet containing steroid hormone LTS勒曼治疗系统股份公司 2018-05-18 CN disclosed
US-20170348321-A1 Wafer Comprising Steroid Hormones LTS LOHMANN THERAPIE-SYSTEME AG (DE) 2017-12-07 US disclosed
US-9763960-B2 Wafer comprising steroid hormones LTS LOHMANN THERAPLE-SYSTEME AG (DE) 2017-09-19 US disclosed
CN-104983669-A TABLET CONTAINING STEROID HORMONES LOHMANN THERAPIE SYST LTS 2015-10-21 CN disclosed
US-20090075328-A1 PROCESS FOR THE OVEREXPRESSION OF DEHYDROGENASES SPELLIG TILMAN 2009-03-19 US disclosed
US-7416866-B2 Process for the overexpression of dehydrogenases SCHERING AG (DE) 2008-08-26 US disclosed
CN-101132766-A Tablet containing steroid hormone LOHMANN THERAPIE SYST LTS (DE) 2008-02-27 CN disclosed
US-20060222708-A1 Wafer comprising steroid hormones BAYER INTELLECTUAL PROPERTY GMBH (DE) 2006-10-05 US disclosed
US-20040091987-A1 Process for the overexpression of dehydrogenases SCHERING AG (DE) 2004-05-13 US disclosed
EP-0876394-B1 PREPARATION OF (11BETA,16BETA)-21-(ACETYLOXY)-11-HYDROXY-2'-METHYL-5'H-PREGNA-1,4-DIENO 17,16-D]OXAZOLE-3,20-DIONE LEPETIT SPA (IT) 2001-05-16 EP disclosed
US-6103895-A ESTERIFICATION OF 21-DEACETYL FLAZACORT WITH ACETIC ANHYDRIDE IN AQUEOUS SOLUTION CONTAINING ORGANIC SOLVENT AND BASIC CATALYST, RECOVERING FLAZACORT GRUPPO LEPETIT S.P.A. (IT) 2000-08-15 US disclosed
EP-0876394-A1 PREPARATION OF (11$g(b),16$g(b))-21-(ACETYLOXY)-11-HYDROXY-2'-METHYL-5'H-PREGNA-1,4-DIENO 17,16-D]OXAZOLE-3,20-DIONE GRUPPO LEPETIT S.p.A. (IT) 1998-11-11 EP disclosed
WO-1997021722-A1 PREPARATION OF (11β,16β)-21-(ACETYLOXY)-11-HYDROXY-2'-METHYL-5'H-PREGNA-1,4-DIENO[17,16-D]OXAZOLE-3,20-DIONE GRUPPO LEPETIT S.P.A. (IT) 1997-06-19 WO disclosed