SCHEMBL6001323

SCHEMBL6001323

C[C@]12C[C@H](O)[C@H]3[C@@H](CCC4=CC(=O)CC(OC(=O)CCC(=O)OC5CC(=O)C=C6CC[C@@H]7[C@H]([C@@H](O)C[C@@]8(C)[C@H]7CC[C@]8(O)C(=O)CO)[C@]65C)[C@@]43C)[C@@H]1CC[C@]2(O)C(=O)CO

nearest known ligand 0.65

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ HIF1A Q16665 12/20 0.65
▸ HSD17B10 Q99714 6/20 0.65
▸ NR3C1 P04150 4/20 0.65
▸ CYP2C19 P33261 4/20 0.65
▸ PGR P06401 4/20 0.65
▸ SERPINA6 P08185 4/20 0.65
▸ CYP3A4 P08684 4/20 0.65
▸ NR3C2 P08235 4/20 0.65
▸ SMN1; SMN2 Q16637 4/20 0.65
▸ NFKB1 P19838 2/20 0.65
▸ MAPT P10636 2/20 0.65
▸ KMT2A Q03164 2/20 0.65
▸ SHBG P04278 2/20 0.65
▸ AR P10275 2/20 0.59
▸ ABCB11 O95342 1/20 0.59
▸ TNF P01375 1/20 0.59
▸ IL6 P05231 1/20 0.59
▸ GLUL P15104 1/20 0.59
▸ ADAM17 P78536 1/20 0.59
▸ GPBAR1 Q8TDU6 1/20 0.59

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
SCHEMBL249836 0.99 HIF1A (0.64) HIF1AHSD17B10NR3C1CYP2C19PGR
SCHEMBL14931695 0.99 HIF1A (0.64) HIF1AHSD17B10NR3C1CYP2C19PGR
SCHEMBL1301994 0.97 HIF1A (0.62) HIF1AHSD17B10NR3C1CYP2C19PGR
SCHEMBL1535104 0.97 HIF1A (0.63) HIF1AHSD17B10NR3C1CYP2C19PGR
SCHEMBL27571456 0.96 HIF1A (0.61) HIF1AHSD17B10NR3C1CYP2C19PGR
SCHEMBL27941428 0.96 HIF1A (0.61) HIF1AHSD17B10NR3C1CYP2C19PGR
SCHEMBL141828 0.96 HIF1A (0.62) HIF1AHSD17B10NR3C1CYP2C19PGR
SCHEMBL28809123 0.96 HIF1A (0.66) HIF1AHSD17B10NR3C1CYP2C19PGR
SCHEMBL41085 0.95 HIF1A (0.63) HIF1AHSD17B10NR3C1CYP2C19PGR
SCHEMBL4450350 0.95 HIF1A (0.61) HIF1AHSD17B10NR3C1CYP2C19PGR

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 21 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-112584874-A Compositions and methods for treating leber's hereditary optic neuropathy 武汉纽福斯生物科技有限公司 2021-03-30 — — CN claimed
CN-110096710-B Article analysis and self-demonstration method 董云鹏 2022-12-30 — — CN disclosed
US-20210290597-A1 METHOD OF TREATING A CONDITION ASSOCIATED WITH NEURODEGENERATION USING INHIBITORS OF OAT3 NEUROPORE THERAPIES, INC. (US) 2021-09-23 — — US disclosed
CN-113286778-A Panamide analogs MMV疟疾药物投资公司 2021-08-20 — — CN disclosed
EP-3810133-A1 METHOD OF TREATING A CONDITION ASSOCIATED WITH NEURODEGENERATION USING INHIBITORS OF OAT3 Neuropore Therapies, Inc. (US) 2021-04-28 — — EP disclosed
CN-112584874-A Compositions and methods for treating leber's hereditary optic neuropathy 武汉纽福斯生物科技有限公司 2021-03-30 — — CN disclosed
CN-112512523-A Methods of treating conditions associated with neurodegenerative disorders using inhibitors of OAT3 神经孔疗法股份有限公司 2021-03-16 — — CN disclosed
EP-2842545-B1 METHOD FOR PRODUCING AN AQUEOUS DISPERSION OF DRUG NANOPARTICLES AND USE THEREOF UNIV OSAKA (JP) 2020-02-12 — — EP disclosed
CN-106924738-B The pharmaceutical composition for preventing lemostenosis 北京大学第三医院 2019-12-03 — — CN disclosed
CN-110214150-A Combination therapy of chimeric antigen receptor and PD-1 inhibitor 诺华股份有限公司 2019-09-06 — — CN disclosed
CN-105820203-B The preparation method of hydrocortisone acetate 湖南成大生物科技有限公司 2017-08-08 — — CN disclosed
CN-106924738-A Prevent the drug regimen of lemostenosis 北京大学第三医院 2017-07-07 — — CN disclosed
CN-104030987-B DIHYDROOROTATE DEHYDROGENASE INHIBITORS 默克雪兰诺有限公司 2017-04-12 — — CN disclosed
US-20150087624-A1 METHOD FOR PRODUCING AN AQUEOUS DISPERSION OF DRUG NANOPARTICLES AND USE THEREOF OSAKA UNIVERSITY (JP) 2015-03-26 — — US disclosed
EP-2842545-A1 METHOD FOR PRODUCING AN AQUEOUS DISPERSION OF DRUG NANOPARTICLES AND USE THEREOF Osaka University (JP) 2015-03-04 — — EP disclosed
CN-101137379-B Cxcr4 antagonists for the treatment of HIV infection UNIV EMORY 2015-02-11 — — CN disclosed
CN-101282761-A Benzimidazole derivatives as SIRTUIN modulators SIRTRIS PHARMACEUTICALS INC (US) 2008-10-08 — — CN disclosed
CN-101137379-A Cxcr4 antagonists for the treatment of HIV infection UNIV EMORY (US) 2008-03-05 — — CN disclosed
US-20060140991-A1 Pharmaceutical preparations having an improved solubility AJINOMOTO CO. INC (JP) 2006-06-29 — — US disclosed
EP-1661556-A1 MEDICINAL PREPARATION HAVING IMPROVED DISSOLUTION PROPERTIES Ajinomoto Co., Inc. (JP) 2006-05-31 — — 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 (2 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-20210290597-A1 METHOD OF TREATING A CONDITION ASSOCIATED WITH NEURODEGENERATION USING INHIBITORS OF OAT3 OAT, CLN6, SLC2A3 HIF1A 2469/4885HSD17B10 687/4885NR3C1 1761/4885
US-20060140991-A1 Pharmaceutical preparations having an improved solubility SI, LSS, PDE8B HIF1A 2142/4885HSD17B10 2433/4885NR3C1 4780/4885

“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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