Diflorasone Diacetate

Diflorasone Diacetate

SCHEMBL10599667

CC(=O)OCC(=O)[C@@]1(OC(C)=O)C(C)C[C@H]2[C@@H]3CC(F)C4=CC(=O)C=C[C@]4(C)[C@@]3(F)C(O)C[C@@]21C

nearest known ligand 1.00 ✓ in ChEMBL — recovers established targets

Full drug profile on Sugi Atlas →

Known targets — ChEMBL curated mechanism

NR3C1

The experimentally established mechanism targets of Diflorasone Diacetate. 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 7/20 1.00
HIF1A Q16665 9/20 1.00
PGR P06401 7/20 1.00
AR P10275 6/20 1.00
CYP3A4 P08684 5/20 1.00
ALDH1A1 P00352 3/20 1.00
SMN1; SMN2 Q16637 3/20 1.00
CYP1A2 P05177 1/20 1.00
ADORA3 P0DMS8 3/20 0.71
CHRM1 P11229 1/20 0.71
ADRA1A P35348 1/20 0.71
LMNA P02545 3/20 0.67
MEN1 O00255 1/20 0.67
KMT2A Q03164 1/20 0.67
NR1I2 O75469 2/20 0.65
NR3C2 P08235 1/20 0.65
MAPT P10636 2/20 0.64
ABCB11 O95342 1/20 0.64
RAB9A P51151 1/20 0.64
NPSR1 Q6W5P4 1/20 0.64

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
Diflorasone Diacetate SCHEMBL14410916 1.00 HIF1A (1.00) HIF1APGRNR3C1ARCYP3A4
Diflorasone Diacetate SCHEMBL4556 1.00 HIF1A (1.00) HIF1APGRNR3C1ARCYP3A4
Diflorasone Diacetate SCHEMBL7101720 1.00 HIF1A (1.00) HIF1APGRNR3C1ARCYP3A4
Diflorasone Diacetate SCHEMBL14339606 1.00 HIF1A (1.00) HIF1APGRNR3C1ARCYP3A4
Diflorasone Diacetate SCHEMBL11020196 1.00 HIF1A (1.00) HIF1APGRNR3C1ARCYP3A4
Diflorasone Diacetate SCHEMBL11020199 1.00 HIF1A (1.00) HIF1APGRNR3C1ARCYP3A4
SCHEMBL11430576 0.94 NR3C1 (0.88) HIF1APGRNR3C1ARCYP3A4
SCHEMBL11423833 0.93 NR3C1 (0.87) HIF1APGRNR3C1ARCYP3A4
SCHEMBL11600201 0.92 NR3C1 (0.85) HIF1APGRNR3C1ARCYP3A4
SCHEMBL3164036 0.92 NR3C1 (0.85) HIF1APGRNR3C1ARCYP3A4

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0186948-B1 PROCESS AND INTERMEDIATES FOR THE PREPARATION OF 17ALPHA-HYDROXYPROGESTERONES AND CORTICOIDS FROM AN ENOL STEROID THE UPJOHN COMPANY (US) 1989-01-25 EP disclosed
US-4613463-A Process and intermediates for the preparation of 17 alphahydroxyprogesterones and corticoids from an enol steroid THE UPJOHN COMPANY (US) 1986-09-23 US disclosed
EP-0186948-A1 Process and intermediates for the preparation of 17alpha-hydroxyprogesterones and corticoids from an enol steroid THE UPJOHN COMPANY (US) 1986-07-09 EP disclosed