SCHEMBL30777667

SCHEMBL30777667

CC1OC2CC3C4CCC5=CC(=O)C=CC5(C)C4C(O)CC3(C)C2(C(=O)CO)O1

nearest known ligand 0.79

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ NR3C1 P04150 14/20 0.79
▸ PGR P06401 8/20 0.79
▸ CYP3A4 P08684 3/20 0.79
▸ HIF1A Q16665 2/20 0.79
▸ CYP2C9 P11712 2/20 0.79
▸ ABCC3 O15438 1/20 0.79
▸ ABCC4 O15439 1/20 0.79
▸ ABCB11 O95342 1/20 0.79
▸ IL5 P05113 1/20 0.79
▸ NR3C2 P08235 1/20 0.79
▸ AR P10275 1/20 0.79
▸ CHRM1 P11229 1/20 0.79
▸ MMP9 P14780 1/20 0.79
▸ NFKB1 P19838 1/20 0.79
▸ THPO P40225 1/20 0.79
▸ SMN1; SMN2 Q16637 1/20 0.79
▸ HSD17B10 Q99714 1/20 0.79
▸ LMNA P02545 1/20 0.79
▸ BLM P54132 1/20 0.79
▸ PMP22 Q01453 1/20 0.79

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
SCHEMBL22601658 1.00 NR3C1 (0.79) NR3C1PGRCYP3A4HIF1ACYP2C9
SCHEMBL21302924 1.00 NR3C1 (0.79) NR3C1PGRCYP3A4HIF1ACYP2C9
SCHEMBL13524231 1.00 NR3C1 (0.79) NR3C1PGRCYP3A4HIF1ACYP2C9
SCHEMBL27071472 1.00 NR3C1 (0.79) NR3C1PGRCYP3A4HIF1ACYP2C9
SCHEMBL13654443 0.92 NR3C1 (0.68) NR3C1PGRCYP3A4HIF1ACYP2C9
SCHEMBL13524560 0.90 NR3C1 (0.66) NR3C1PGRCYP3A4HIF1ACYP2C9
SCHEMBL24622229 0.90 NR3C1 (0.88) NR3C1PGRCYP3A4HIF1ACYP2C9
SCHEMBL12314028 0.90 NR3C1 (0.88) NR3C1PGRCYP3A4HIF1ACYP2C9
SCHEMBL13652071 0.90 NR3C1 (0.88) NR3C1PGRCYP3A4HIF1ACYP2C9
Budesonide SCHEMBL21570019 0.89 NR3C1 (1.00) NR3C1PGRCYP3A4HIF1ACYP2C9

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-117571884-A High performance liquid chromatography detection method for substances related to budesonide lotion 南京科默生物医药有限公司 2024-02-20 — — CN disclosed
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