SCHEMBL5084676

SCHEMBL5084676

CCCCCC(=O)O[C@]1(C(=O)CO)CC[C@H]2[C@@H]3CCC4=CC(=O)CC[C@]4(C)[C@H]3[C@@H](O)C[C@@]21C

nearest known ligand 1.00 ✓ in ChEMBL — recovers established targets

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
NR3C2 P08235 8/20 1.00
HIF1A Q16665 7/20 0.97
KMT2A Q03164 3/20 0.97
PGR P06401 4/20 0.89
NR3C1 P04150 4/20 0.89
SMN1; SMN2 Q16637 4/20 0.69
MAPT P10636 3/20 0.69
POLB P06746 1/20 0.69
GAA P10253 1/20 0.69
AR P10275 2/20 0.69
CHRM1 P11229 1/20 0.69
CYP3A4 P08684 2/20 0.65
HPGD P15428 1/20 0.65
MEN1 O00255 1/20 0.65
MLNR O43193 1/20 0.65
NR1I2 O75469 1/20 0.65
LMNA P02545 1/20 0.65
ADORA3 P0DMS8 1/20 0.65
HTT P42858 1/20 0.65
SLC6A3 Q01959 1/20 0.65

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
SCHEMBL20668516 1.00 NR3C2 (1.00) NR3C2HIF1AKMT2APGRNR3C1
SCHEMBL14935923 1.00 NR3C2 (1.00) NR3C2HIF1AKMT2APGRNR3C1
SCHEMBL14935780 0.99 NR3C2 (1.00) NR3C2HIF1AKMT2APGRNR3C1
SCHEMBL20668513 0.99 NR3C2 (1.00) NR3C2HIF1AKMT2APGRNR3C1
SCHEMBL7137194 0.99 NR3C2 (1.00) NR3C2HIF1AKMT2APGRNR3C1
SCHEMBL14935882 0.99 NR3C2 (1.00) NR3C2HIF1AKMT2APGRNR3C1
SCHEMBL28378823 0.99 NR3C2 (1.00) NR3C2HIF1AKMT2APGRNR3C1
SCHEMBL7144935 0.99 NR3C2 (1.00) NR3C2HIF1AKMT2APGRNR3C1
SCHEMBL7142707 0.99 NR3C2 (1.00) NR3C2HIF1AKMT2APGRNR3C1
SCHEMBL14936016 0.99 NR3C2 (1.00) NR3C2HIF1AKMT2APGRNR3C1

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 33 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-10188667-B2 Pharmaceutical compositions and methods of use of 4-pregenen-11β-17-21-triol-3,20-dione derivatives ALLERGAN, INC. (US) 2019-01-29 US claimed
US-20180147217-A1 PHARMACEUTICAL COMPOSITIONS AND METHODS OF USE OF 4-PREGENEN-11BETA-17-21-TRIOL-3,20-DIONE DERIVATIVES ALLERGAN INC (US) 2018-05-31 US claimed
US-9717743-B2 Pharmaceutical compositions and methods of use of 4-pregenen-11β-17-21-triol-3,20-dione derivatives ALLERGAN, INC. (US) 2017-08-01 US claimed
US-20150005519-A1 PHARMACEUTICAL COMPOSITIONS AND METHODS OF USE OF 4-PREGENEN-11BETA-17-21-TRIOL-3,20-DIONE DERIVATIVES ALLERGAN, INC. (US) 2015-01-01 US claimed
US-8865691-B2 Pharmaceutical compositions and methods of use 4-pregenen-11β-17-21-triol-3,20-dione derivatives ALLERGAN, INC. (US) 2014-10-21 US claimed
US-20130123226-A1 PHARAMCEUTICAL COMPOSITIONS AND METHODS OF USE 4-PREGENEN-11BETA-17-21-TRIOL-3,20-DIONE DERIVATIVES ALLERGAN, INC. (US) 2013-05-16 US claimed
US-20080166398-A1 Sertaconazole and hydrocortisone; for dermal diseases; inflammation FERRER INTERNACIONAL, S.A. (ES) 2008-07-10 US claimed
EP-1858510-A1 ANTIFUNGAL COMPOSITIONS COMPRISING SERTACONAZOL AND HYDROCORTISONE AND/OR AN ANTIBACTERIAL QUINOLONE COMPOUND FERRER INTERNACIONAL, S.A. (ES) 2007-11-28 EP claimed
WO-2006092374-A1 ANTIFUNGAL COMPOSITIONS COMPRISING SERTACONAZOL AND HYDROCORTISONE AND/OR AN ANTIBACTERIAL QUINOLONE COMPOUND FERRER INTERNACIONAL, S. A. (ES) 2006-09-08 WO claimed
EP-1698336-A1 Antifungal compositions comprising Sertaconazole and either Hydrocortisone or an antibacterial agent FERRER INTERNACIONAL, S.A. (ES) 2006-09-06 EP claimed
US-20240307299-A1 SELF-EMULSIFYING DRUG DELIVERY (SEDDS) FOR OPHTHALMIC DRUG DELIVERY ALLERGAN, INC. 2024-09-19 US disclosed
US-20220218599-A1 SELF-EMULSIFYING DRUG DELIVERY (SEDDS) FOR OPHTHALMIC DRUG DELIVERY ALLERGAN, INC. 2022-07-14 US disclosed
WO-2019055028-A1 PARTICLES, COMPOSITIONS, AND METHODS FOR OPHTHALMIC AND/OR OTHER APPLICATIONS KALA PHARMACEUTICALS, INC. (US) 2019-03-21 WO disclosed
US-10188667-B2 Pharmaceutical compositions and methods of use of 4-pregenen-11β-17-21-triol-3,20-dione derivatives ALLERGAN, INC. (US) 2019-01-29 US disclosed
US-20180147217-A1 PHARMACEUTICAL COMPOSITIONS AND METHODS OF USE OF 4-PREGENEN-11BETA-17-21-TRIOL-3,20-DIONE DERIVATIVES ALLERGAN INC (US) 2018-05-31 US disclosed
WO-2006092374-A1 ANTIFUNGAL COMPOSITIONS COMPRISING SERTACONAZOL AND HYDROCORTISONE AND/OR AN ANTIBACTERIAL QUINOLONE COMPOUND FERRER INTERNACIONAL, S. A. (ES) 2006-09-08 WO disclosed
EP-1698336-A1 Antifungal compositions comprising Sertaconazole and either Hydrocortisone or an antibacterial agent FERRER INTERNACIONAL, S.A. (ES) 2006-09-06 EP disclosed
EP-1308500-A1 Ophthalmic composition Menicon Co., Ltd. (JP) 2003-05-07 EP disclosed
US-5489576-A ADMINISTERING ASCORBIC ACID ALPHA-TOCOPHERYL PHOSPHATE DIESTER SENJU PHARMACEUTICAL CO., LTD. (JP) 1996-02-06 US disclosed
EP-0661053-A1 Use of tocopherol ascorbic adic phosphates for hemorrhoidal diseases Senju Pharmaceutical Co., Ltd. (JP) 1995-07-05 EP 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 (6 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-20150005519-A1 PHARMACEUTICAL COMPOSITIONS AND METHODS OF USE OF 4-PREGENEN-11BETA-17-21-TRIOL-3,20-DIONE DERIVATIVES NR3C2, MC2R, NR3C1 NR3C2 1/4885HIF1A 4264/4885KMT2A 4628/4885
US-20180147217-A1 PHARMACEUTICAL COMPOSITIONS AND METHODS OF USE OF 4-PREGENEN-11BETA-17-21-TRIOL-3,20-DIONE DERIVATIVES NR3C2, MC2R, NR3C1 NR3C2 1/4885HIF1A 4264/4885KMT2A 4628/4885
US-20130123226-A1 PHARAMCEUTICAL COMPOSITIONS AND METHODS OF USE 4-PREGENEN-11BETA-17-21-TRIOL-3,20-DIONE DERIVATIVES NR3C2, NR3C1, HSD11B2 NR3C2 1/4885HIF1A 3606/4885KMT2A 4238/4885
US-20220218599-A1 SELF-EMULSIFYING DRUG DELIVERY (SEDDS) FOR OPHTHALMIC DRUG DELIVERY LSS, SBDS, SPAST NR3C2 2701/4885HIF1A 1419/4885KMT2A 4501/4885
US-10188667-B2 Pharmaceutical compositions and methods of use of 4-pregenen-11β-17-21-triol-3,20-dione derivatives NR3C2, MC2R, NR3C1 NR3C2 1/4885HIF1A 4152/4885KMT2A 4615/4885
US-20240307299-A1 SELF-EMULSIFYING DRUG DELIVERY (SEDDS) FOR OPHTHALMIC DRUG DELIVERY LSS, SBDS, SPAST NR3C2 2701/4885HIF1A 1419/4885KMT2A 4501/4885

“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.