SCHEMBL7594045

SCHEMBL7594045

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

nearest known ligand 0.53

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ NR3C1 P04150 7/20 0.53
▸ PGR P06401 7/20 0.51
▸ CYP3A4 P08684 6/20 0.51
▸ AR P10275 3/20 0.51
▸ F2 P00734 1/20 0.51
▸ HIF1A Q16665 6/20 0.51
▸ USP2 O75604 5/20 0.51
▸ LMNA P02545 3/20 0.51
▸ ALDH1A1 P00352 2/20 0.51
▸ CYP2C9 P11712 2/20 0.51
▸ CNR1 P21554 2/20 0.51
▸ KDM4E B2RXH2 1/20 0.51
▸ TDP1 Q9NUW8 1/20 0.51
▸ ABCB11 O95342 2/20 0.49
▸ NR1I2 O75469 2/20 0.47
▸ HSD17B10 Q99714 1/20 0.47
▸ ABCC4 O15439 1/20 0.47
▸ PDE4D Q08499 1/20 0.47
▸ CYP2D6 P10635 1/20 0.46
▸ ADORA3 P0DMS8 2/20 0.42

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 0.87 NR3C1 (0.63) NR3C1PGRCYP3A4ARF2
SCHEMBL10427816 0.86 PGR (0.67) NR3C1PGRCYP3A4ARF2
SCHEMBL10427815 0.86 PGR (0.67) NR3C1PGRCYP3A4ARF2
SCHEMBL7596820 0.86 PGR (0.61) NR3C1PGRCYP3A4ARF2
SCHEMBL10427859 0.83 PGR (0.66) NR3C1PGRCYP3A4ARF2
SCHEMBL10356202 0.83 PGR (0.66) NR3C1PGRCYP3A4ARF2
SCHEMBL10356203 0.83 PGR (0.66) NR3C1PGRCYP3A4ARF2
SCHEMBL10427790 0.82 PGR (0.64) NR3C1PGRCYP3A4ARF2
SCHEMBL10427789 0.82 PGR (0.64) NR3C1PGRCYP3A4ARF2
SCHEMBL10803758 0.81 PGR (0.70) NR3C1PGRCYP3A4ARF2

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-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
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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