SCHEMBL29666990

SCHEMBL29666990

CCCC1OC2CC3C4CC(O)C5=CC(=O)C=CC5(C)C4C(O)CC3(C)C2(C(=O)CO)O1

nearest known ligand 0.76

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ NR3C1 P04150 9/20 0.76
▸ CYP3A4 P08684 6/20 0.76
▸ PGR P06401 6/20 0.76
▸ HIF1A Q16665 4/20 0.76
▸ ABCB11 O95342 3/20 0.76
▸ HSD17B10 Q99714 3/20 0.76
▸ LMNA P02545 2/20 0.76
▸ AR P10275 2/20 0.76
▸ ABCC4 O15439 2/20 0.76
▸ ABCC3 O15438 1/20 0.76
▸ IL5 P05113 1/20 0.76
▸ NR3C2 P08235 1/20 0.76
▸ CHRM1 P11229 1/20 0.76
▸ MMP9 P14780 1/20 0.76
▸ NFKB1 P19838 1/20 0.76
▸ THPO P40225 1/20 0.76
▸ SMN1; SMN2 Q16637 1/20 0.76
▸ BLM P54132 1/20 0.76
▸ PMP22 Q01453 1/20 0.76
▸ NPSR1 Q6W5P4 1/20 0.76

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
SCHEMBL8499750 0.94 NR3C1 (0.74) NR3C1CYP3A4PGRHIF1AABCB11
Budesonide SCHEMBL12396756 0.86 NR3C1 (1.00) NR3C1CYP3A4PGRHIF1AABCB11
Budesonide SCHEMBL8056801 0.86 NR3C1 (1.00) NR3C1CYP3A4PGRHIF1AABCB11
Budesonide SCHEMBL16731476 0.86 NR3C1 (1.00) NR3C1CYP3A4PGRHIF1AABCB11
Budesonide SCHEMBL1130417 0.86 NR3C1 (1.00) NR3C1CYP3A4PGRHIF1AABCB11
Budesonide SCHEMBL14452945 0.86 NR3C1 (1.00) NR3C1CYP3A4PGRHIF1AABCB11
Budesonide SCHEMBL1786635 0.86 NR3C1 (1.00) NR3C1CYP3A4PGRHIF1AABCB11
Budesonide SCHEMBL13871728 0.86 NR3C1 (1.00) NR3C1CYP3A4PGRHIF1AABCB11
Budesonide SCHEMBL21570019 0.86 NR3C1 (1.00) NR3C1CYP3A4PGRHIF1AABCB11
Budesonide SCHEMBL13695912 0.86 NR3C1 (1.00) NR3C1CYP3A4PGRHIF1AABCB11

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
CN-116660543-A Diagnostic and prognostic markers for nonalcoholic fatty liver disease and uses thereof 中国人民解放军陆军军医大学第一附属医院 2023-08-29 — — CN claimed
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