SCHEMBL7598319

SCHEMBL7598319

CCOC(=O)O[C@]1(C(=O)CO)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 0.61

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ PGR P06401 8/20 0.61
▸ CYP3A4 P08684 7/20 0.61
▸ NR3C1 P04150 6/20 0.61
▸ HIF1A Q16665 4/20 0.61
▸ LMNA P02545 2/20 0.61
▸ USP2 O75604 1/20 0.61
▸ CYP2D6 P10635 1/20 0.61
▸ CYP2C9 P11712 1/20 0.61
▸ AR P10275 4/20 0.60
▸ ABCB11 O95342 5/20 0.58
▸ NR1I2 O75469 2/20 0.58
▸ ABCC3 O15438 1/20 0.58
▸ HSD17B10 Q99714 4/20 0.57
▸ ALDH1A1 P00352 1/20 0.57
▸ ABCC4 O15439 1/20 0.57
▸ PDE4D Q08499 1/20 0.57
▸ ADRA1A P35348 2/20 0.56
▸ CYP2C19 P33261 2/20 0.56
▸ KDM4E B2RXH2 1/20 0.56
▸ HTR1A P08908 1/20 0.56

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
SCHEMBL11284506 0.94 PGR (0.59) PGRCYP3A4NR3C1HIF1ALMNA
SCHEMBL11288394 0.93 PGR (0.58) PGRCYP3A4NR3C1HIF1ALMNA
SCHEMBL11422372 0.93 PGR (0.66) PGRCYP3A4NR3C1HIF1ALMNA
SCHEMBL11292566 0.92 PGR (0.62) PGRCYP3A4NR3C1HIF1ALMNA
SCHEMBL11424745 0.92 PGR (0.57) PGRCYP3A4NR3C1HIF1ALMNA
SCHEMBL11424493 0.92 PGR (0.65) PGRCYP3A4NR3C1HIF1ALMNA
SCHEMBL7596514 0.91 PGR (0.69) PGRCYP3A4NR3C1HIF1ALMNA
SCHEMBL11425616 0.91 PGR (0.75) PGRCYP3A4NR3C1HIF1ALMNA
SCHEMBL11436872 0.91 PGR (0.64) PGRCYP3A4NR3C1HIF1ALMNA
SCHEMBL11379457 0.90 PGR (0.62) PGRCYP3A4NR3C1HIF1ALMNA

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 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
US-4242334-A ANTIINFLAMMATORY AGENTS; SKIN DISORDERS HOECHST AKTIENGESELLSCHAFT (DE) 1980-12-30 — — US disclosed
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