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Sugi Predict / Compounds / Fluocinonide

Fluocinonide

Fluocinonide

SCHEMBL5664031

CC(=O)OCC(=O)[C@@]1(O)CC[C@H]2[C@@H]3CCC4=CC(=O)CC[C@]4(C)[C@H]3[C@@H](O)C[C@@]21C.CC(=O)OCC(=O)[C@@]12OC(C)(C)O[C@@H]1C[C@H]1[C@@H]3C[C@H](F)C4=CC(=O)C=C[C@]4(C)[C@@]3(F)[C@@H](O)C[C@@]12C.CC1(C)O[C@@H]2C[C@H]3[C@@H]4C[C@H](F)C5=CC(=O)CC[C@]5(C)[C@H]4[C@@H](O)C[C@]3(C)[C@]2(C(=O)CO)O1

nearest known ligand 0.62

Full drug profile on Sugi Atlas →

Known targets — ChEMBL curated mechanism

NR3C1

The experimentally established mechanism targets of Fluocinonide. 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 9/20 0.62
▸ HIF1A Q16665 8/20 0.62
▸ LMNA P02545 8/20 0.62
▸ PGR P06401 8/20 0.62
▸ AR P10275 4/20 0.62
▸ ALDH1A1 P00352 1/20 0.62
▸ MEN1 O00255 1/20 0.62
▸ KMT2A Q03164 1/20 0.62
▸ CYP3A4 P08684 6/20 0.58
▸ NPSR1 Q6W5P4 2/20 0.58
▸ ABCB11 O95342 2/20 0.58
▸ SMN1; SMN2 Q16637 1/20 0.58
▸ MAPT P10636 2/20 0.57
▸ HSD17B10 Q99714 2/20 0.57
▸ KDM4E B2RXH2 2/20 0.57
▸ TDP1 Q9NUW8 1/20 0.57
▸ MAPK1 P28482 1/20 0.57
▸ SERPINA6 P08185 1/20 0.53
▸ CHRM1 P11229 1/20 0.53
▸ CNR1 P21554 1/20 0.50

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
Fluocinonide SCHEMBL15568196 0.90 HIF1A (0.58) NR3C1HIF1ALMNAPGRAR
Flurandrenolide SCHEMBL28118985 0.86 HIF1A (0.65) NR3C1HIF1ALMNAPGRAR
Fluocinolone Acetonide SCHEMBL8451856 0.86 NR3C1 (0.60) NR3C1HIF1ALMNAPGRAR
Fluocinolone Acetonide SCHEMBL15568127 0.85 HIF1A (0.57) NR3C1HIF1ALMNAPGRAR
Fluocinonide SCHEMBL616754 0.85 NR3C1 (0.74) NR3C1HIF1ALMNAPGRAR
Flurandrenolide SCHEMBL28086640 0.83 HIF1A (0.69) NR3C1HIF1ALMNAPGRAR
Prednicarbate SCHEMBL6470591 0.83 NR3C1 (0.57) NR3C1HIF1ALMNAPGRAR
Fluocinonide SCHEMBL28161334 0.83 HIF1A (0.58) NR3C1HIF1ALMNAPGRAR
Fluocinonide SCHEMBL8425065 0.82 HIF1A (0.64) NR3C1HIF1ALMNAPGRAR
Fluocinonide SCHEMBL2863286 0.82 HIF1A (0.58) NR3C1HIF1ALMNAPGRAR

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-1562627-A4 CORTICOSTEROID CONJUGATES AND USES THEREOF MCLEAN HOSPITAL CORP (US) 2006-11-02 — — EP disclosed
EP-1562627-A2 CORTICOSTEROID CONJUGATES AND USES THEREOF The McLean Hospital Corporation (US) 2005-08-17 — — EP disclosed
WO-2004017904-A2 CORTICOSTEROID CONJUGATES AND USES THEREOF THE MCLEAN HOSPITAL CORPORATION (US) 2004-03-04 — — WO disclosed
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