SCHEMBL10625960

SCHEMBL10625960

CCC(=O)[C@@]1(OCOC)[C@@H](C)C[C@H]2[C@@H]3C[C@H](C)C4=CC(=O)C=C[C@]4(C)[C@H]3[C@@H](O)C[C@@]21C

nearest known ligand 0.56

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ PGR P06401 8/20 0.56
▸ NR3C1 P04150 7/20 0.56
▸ CYP3A4 P08684 6/20 0.56
▸ HIF1A Q16665 4/20 0.56
▸ ABCB11 O95342 3/20 0.56
▸ NR1I2 O75469 2/20 0.56
▸ ALDH1A1 P00352 2/20 0.56
▸ HSD17B10 Q99714 2/20 0.56
▸ ABCC4 O15439 1/20 0.56
▸ PDE4D Q08499 1/20 0.56
▸ AR P10275 4/20 0.54
▸ F2 P00734 1/20 0.54
▸ LMNA P02545 3/20 0.52
▸ CNR1 P21554 2/20 0.52
▸ USP2 O75604 2/20 0.45
▸ KDM4E B2RXH2 2/20 0.45
▸ CYP2C9 P11712 1/20 0.45
▸ TDP1 Q9NUW8 1/20 0.45
▸ ADRA1A P35348 3/20 0.44
▸ CYP2C19 P33261 1/20 0.44

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
SCHEMBL10625977 1.00 PGR (0.56) PGRNR3C1CYP3A4HIF1AABCB11
SCHEMBL10427878 0.93 NR3C1 (0.62) PGRNR3C1CYP3A4HIF1AABCB11
SCHEMBL10427875 0.93 NR3C1 (0.62) PGRNR3C1CYP3A4HIF1AABCB11
SCHEMBL10427898 0.90 PGR (0.66) PGRNR3C1CYP3A4HIF1AABCB11
SCHEMBL10427880 0.90 PGR (0.66) PGRNR3C1CYP3A4HIF1AABCB11
SCHEMBL10427756 0.87 NR3C1 (0.61) PGRNR3C1CYP3A4HIF1AABCB11
SCHEMBL10427848 0.87 NR3C1 (0.61) PGRNR3C1CYP3A4HIF1AABCB11
SCHEMBL10427788 0.84 PGR (0.64) PGRNR3C1CYP3A4HIF1AABCB11
SCHEMBL10427758 0.84 PGR (0.64) PGRNR3C1CYP3A4HIF1AABCB11
SCHEMBL9807831 0.83 PGR (0.55) PGRNR3C1CYP3A4HIF1AABCB11

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-4777165-A 6α, 16β-dimethyl corticoids and their anti-inflammatory use SCHERING AKTIENGESELLSCHAFT (DE) 1988-10-11 — — US disclosed
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