SCHEMBL7599781

SCHEMBL7599781

CCOC(=O)O[C@]1(C(=O)COC(=O)Cc2ccccc2)CC[C@H]2[C@@H]3C[C@H](F)C4=CC(=O)C=C[C@]4(C)[C@H]3C(O)C[C@@]21C

nearest known ligand 0.62

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ NR3C1 P04150 8/20 0.62
▸ PGR P06401 7/20 0.62
▸ CYP3A4 P08684 6/20 0.62
▸ HIF1A Q16665 4/20 0.62
▸ LMNA P02545 3/20 0.62
▸ USP2 O75604 1/20 0.62
▸ CYP2D6 P10635 1/20 0.62
▸ CYP2C9 P11712 1/20 0.62
▸ ABCB11 O95342 4/20 0.51
▸ NR1I2 O75469 2/20 0.51
▸ ABCC3 O15438 1/20 0.51
▸ AR P10275 3/20 0.48
▸ F2 P00734 1/20 0.48
▸ NR3C2 P08235 1/20 0.47
▸ NPSR1 Q6W5P4 1/20 0.45
▸ ADRA1A P35348 2/20 0.45
▸ ADORA3 P0DMS8 1/20 0.45
▸ CHRM1 P11229 1/20 0.45
▸ SLC6A2 P23975 1/20 0.45
▸ SLC6A3 Q01959 1/20 0.45

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
SCHEMBL7595133 0.93 NR3C1 (0.63) NR3C1PGRCYP3A4HIF1ALMNA
SCHEMBL6859977 0.92 HIF1A (0.55) NR3C1PGRCYP3A4HIF1ALMNA
SCHEMBL6859979 0.92 HIF1A (0.55) NR3C1PGRCYP3A4HIF1ALMNA
SCHEMBL11425616 0.91 PGR (0.75) NR3C1PGRCYP3A4HIF1ALMNA
SCHEMBL11422372 0.90 PGR (0.66) NR3C1PGRCYP3A4HIF1ALMNA
SCHEMBL11436169 0.90 PGR (0.66) NR3C1PGRCYP3A4HIF1ALMNA
SCHEMBL11431166 0.90 PGR (0.66) NR3C1PGRCYP3A4HIF1ALMNA
SCHEMBL11426580 0.89 PGR (0.65) NR3C1PGRCYP3A4HIF1ALMNA
SCHEMBL11433463 0.89 PGR (0.67) NR3C1PGRCYP3A4HIF1ALMNA
SCHEMBL11424493 0.89 PGR (0.65) NR3C1PGRCYP3A4HIF1ALMNA

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0640616-B1 17-Alkylcarbonate, 21-0-carbonic/carboxylic acid esters of corticosteroids, a method for their production and pharmaceutical compositions containing them HOECHST AG (DE) 2002-11-27 — — EP claimed
EP-0640616-B1 17-Alkylcarbonate, 21-0-carbonic/carboxylic acid esters of corticosteroids, a method for their production and pharmaceutical compositions containing them HOECHST AG (DE) 2002-11-27 — — EP disclosed
US-5608093-A ANTIINFLAMMATORY AGENTS HOECHST AKTIENGESELLSCHAFT (DE) 1997-03-04 — — US disclosed
EP-0640616-A2 17-Alkylcarbonate, 21-0-carbonic/carboxylic acid esters of corticosteroids, a method for their production and pharmaceutical compositions containing them HOECHST AKTIENGESELLSCHAFT (DE) 1995-03-01 — — EP disclosed
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