SCHEMBL2020336

SCHEMBL2020336

CCCC1O[C@@H]2C[C@H]3[C@@H]4CCC5=CC(=O)CC[C@]5(C)[C@H]4[C@@H](O)C[C@]3(C)[C@]2(C(=O)O)O1

nearest known ligand 0.71

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ HIF1A Q16665 8/20 0.62
▸ CYP3A4 P08684 4/20 0.62
▸ NR3C1 P04150 4/20 0.62
▸ NR3C2 P08235 4/20 0.62
▸ PGR P06401 4/20 0.62
▸ HSD17B10 Q99714 3/20 0.62
▸ LMNA P02545 3/20 0.62
▸ NFKB1 P19838 2/20 0.62
▸ SMN1; SMN2 Q16637 2/20 0.62
▸ AR P10275 2/20 0.62
▸ CHRM1 P11229 2/20 0.62
▸ ABCC3 O15438 1/20 0.62
▸ ABCC4 O15439 1/20 0.62
▸ ABCB11 O95342 1/20 0.62
▸ IL5 P05113 1/20 0.62
▸ MMP9 P14780 1/20 0.62
▸ THPO P40225 1/20 0.62
▸ BLM P54132 1/20 0.62
▸ PMP22 Q01453 1/20 0.62
▸ NPSR1 Q6W5P4 1/20 0.62

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
SCHEMBL2016044 0.93 NR3C1 (0.73) HIF1ACYP3A4NR3C1NR3C2PGR
SCHEMBL7735918 0.89 ALDH1A1 (0.64) HIF1ACYP3A4NR3C1NR3C2PGR
SCHEMBL7735905 0.88 HIF1A (0.66) HIF1ACYP3A4NR3C1NR3C2PGR
SCHEMBL9199016 0.88 HIF1A (0.55) HIF1ACYP3A4NR3C1NR3C2PGR
SCHEMBL2017730 0.87 NR3C1 (0.59) HIF1ACYP3A4NR3C1NR3C2PGR
SCHEMBL2017765 0.87 NR3C1 (0.57) HIF1ACYP3A4NR3C1NR3C2PGR
SCHEMBL7741842 0.85 HIF1A (0.60) HIF1ACYP3A4NR3C1NR3C2PGR
SCHEMBL7743570 0.84 HIF1A (0.50) HIF1ACYP3A4NR3C1NR3C2PGR
SCHEMBL2019946 0.83 HIF1A (0.61) HIF1ACYP3A4NR3C1NR3C2PGR
SCHEMBL7741860 0.83 NR3C1 (0.86) HIF1ACYP3A4NR3C1NR3C2PGR

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
US-20110160167-A1 Steroid Derivatives Acting As Glucocorticosteroid Receptor Agonists ASTRAZENECA AB (SE) 2011-06-30 — — US disclosed
US-20110160167-A1 Steroid Derivatives Acting As Glucocorticosteroid Receptor Agonists ASTRAZENECA AB (SE) 2011-06-30 — — US disclosed
WO-2009082342-A1 STEROID DERIVATIVES ACTING AS GLUCOCORTICOSTEROID RECEPTOR AGONISTS ASTRAZENECA AB (SE) 2009-07-02 — — WO disclosed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (1 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.

PatentTitleText reads most aboutPredicted target · text-rank
US-20110160167-A1 Steroid Derivatives Acting As Glucocorticosteroid Receptor Agonists NR3C1, NR3C2, MC2R HIF1A 3437/4885CYP3A4 360/4885NR3C1 1/4885

“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.

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