SCHEMBL2016044

SCHEMBL2016044

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)CO)O1

nearest known ligand 0.73

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ NR3C1 P04150 8/20 0.73
▸ HIF1A Q16665 6/20 0.73
▸ NR3C2 P08235 5/20 0.73
▸ CYP3A4 P08684 4/20 0.73
▸ HSD17B10 Q99714 3/20 0.73
▸ PGR P06401 3/20 0.73
▸ NFKB1 P19838 2/20 0.73
▸ SMN1; SMN2 Q16637 2/20 0.73
▸ ABCC3 O15438 1/20 0.73
▸ ABCC4 O15439 1/20 0.73
▸ ABCB11 O95342 1/20 0.73
▸ IL5 P05113 1/20 0.73
▸ AR P10275 1/20 0.73
▸ CHRM1 P11229 1/20 0.73
▸ MMP9 P14780 1/20 0.73
▸ THPO P40225 1/20 0.73
▸ LMNA P02545 1/20 0.73
▸ BLM P54132 1/20 0.73
▸ PMP22 Q01453 1/20 0.73
▸ NPSR1 Q6W5P4 1/20 0.73

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
SCHEMBL7735905 0.95 HIF1A (0.66) NR3C1HIF1ANR3C2CYP3A4HSD17B10
SCHEMBL2020336 0.93 HIF1A (0.62) NR3C1HIF1ANR3C2CYP3A4HSD17B10
SCHEMBL7735918 0.90 ALDH1A1 (0.64) NR3C1HIF1ANR3C2CYP3A4HSD17B10
SCHEMBL13654495 0.89 HIF1A (0.63) NR3C1HIF1ANR3C2CYP3A4HSD17B10
Dexbudesonide SCHEMBL8159866 0.88 NR3C1 (0.78) NR3C1HIF1ANR3C2CYP3A4HSD17B10
SCHEMBL2017765 0.88 NR3C1 (0.57) NR3C1HIF1ANR3C2CYP3A4HSD17B10
Dexbudesonide SCHEMBL8513617 0.87 NR3C1 (0.75) NR3C1HIF1ANR3C2CYP3A4HSD17B10
SCHEMBL10539776 0.86 NR3C1 (0.74) NR3C1HIF1ANR3C2CYP3A4HSD17B10
SCHEMBL8500349 0.86 NR3C1 (0.74) NR3C1HIF1ANR3C2CYP3A4HSD17B10
SCHEMBL10538489 0.86 NR3C1 (0.74) NR3C1HIF1ANR3C2CYP3A4HSD17B10

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-116106439-B Method for simultaneously detecting multiple genotoxic impurities in medicine 上海方予健康医药科技有限公司 2025-04-15 — — CN claimed
CN-116136523-A Separation detection method for formoterol powder fog agent content of budesonide fumarate 苏州易合医药有限公司 2023-05-19 — — CN claimed
CN-116106439-A Method for simultaneously detecting multiple genotoxic impurities in medicine 上海方予健康医药科技有限公司 2023-05-12 — — CN claimed
EP-0502092-B1 ORAL COMPOSITION FOR THE TREATMENT OF INFLAMMATORY BOWEL DISEASES DRACO AB (SE) 1995-07-26 — — EP claimed
CN-116106439-B Method for simultaneously detecting multiple genotoxic impurities in medicine 上海方予健康医药科技有限公司 2025-04-15 — — CN disclosed
CN-116106439-B Method for simultaneously detecting multiple genotoxic impurities in medicine 上海方予健康医药科技有限公司 2025-04-15 — — CN disclosed
CN-119224177-A Impurity analysis method for budesonide inhalation solution 浙江福瑞喜药业有限公司 2024-12-31 — — CN disclosed
CN-119224177-A Impurity analysis method for budesonide inhalation solution 浙江福瑞喜药业有限公司 2024-12-31 — — CN disclosed
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
CN-116136523-A Separation detection method for formoterol powder fog agent content of budesonide fumarate 苏州易合医药有限公司 2023-05-19 — — CN disclosed
CN-116106439-A Method for simultaneously detecting multiple genotoxic impurities in medicine 上海方予健康医药科技有限公司 2023-05-12 — — CN disclosed
CN-116106439-A Method for simultaneously detecting multiple genotoxic impurities in medicine 上海方予健康医药科技有限公司 2023-05-12 — — CN disclosed
CN-113444137-B Method for synthesizing 16, 21-cyclic hemiacetal of 17-deoxyprednisolone 成都倍特药业股份有限公司 2022-07-29 — — CN disclosed
CN-113444137-B Method for synthesizing 16, 21-cyclic hemiacetal of 17-deoxyprednisolone 成都倍特药业股份有限公司 2022-07-29 — — CN disclosed
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
US-20110160167-A1 Steroid Derivatives Acting As Glucocorticosteroid Receptor Agonists ASTRAZENECA AB (SE) 2011-06-30 — — US disclosed
US-6423340-B1 GASTROINTESTINAL DISORDERS, CROHN'S COLITIS AKTIEBOLAGET DRACO (SE) 2002-07-23 — — US disclosed
US-5643602-A TIME RELEASE PELLETS FOR INTESTINES ASTRA AKTIEBOLAG (SE) 1997-07-01 — — US disclosed
EP-0502092-B1 ORAL COMPOSITION FOR THE TREATMENT OF INFLAMMATORY BOWEL DISEASES DRACO AB (SE) 1995-07-26 — — EP 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 NR3C1 1/4885HIF1A 3437/4885NR3C2 2/4885

“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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