Heracleninprangenin

Heracleninprangenin

SCHEMBL19346337

CC1(C)OC1COc1c2occc2cc2ccc(=O)oc12

nearest known ligand 1.00 ✓ in ChEMBL — recovers established targets

Full drug profile on Sugi Atlas →

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ RECQL P46063 1/20 1.00
▸ MAOA P21397 3/20 0.62
▸ CYP3A4 P08684 4/20 0.61
▸ CYP1A2 P05177 1/20 0.61
▸ CYP2D6 P10635 1/20 0.61
▸ CYP2A6 P11509 1/20 0.61
▸ TSHR P16473 1/20 0.61
▸ ACHE P22303 1/20 0.61
▸ PDE4A P27815 1/20 0.61
▸ MAPK1 P28482 1/20 0.61
▸ CYP2C19 P33261 1/20 0.61
▸ SLC6A3 Q01959 1/20 0.61
▸ CYP2A13 Q16696 1/20 0.61
▸ ALDH1A1 P00352 6/20 0.60
▸ BACE1 P56817 2/20 0.60
▸ GAA P10253 2/20 0.60
▸ ABCB1 P08183 1/20 0.60
▸ CYP1B1 Q16678 1/20 0.60
▸ KDM4E B2RXH2 5/20 0.60
▸ HSD17B10 Q99714 3/20 0.60

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
Heraclenin SCHEMBL32689650 1.00 RECQL (1.00) RECQLMAOACYP3A4CYP1A2CYP2D6
Heracleninprangenin SCHEMBL29067650 1.00 RECQL (1.00) RECQLMAOACYP3A4CYP1A2CYP2D6
SCHEMBL8806449 0.81 CYP3A4 (0.71) RECQLMAOACYP3A4CYP1A2CYP2D6
SCHEMBL7781220 0.79 CYP3A4 (0.72) RECQLMAOACYP3A4CYP1A2CYP2D6
SCHEMBL9184365 0.79 MAOA (0.76) RECQLMAOACYP3A4CYP1A2CYP2D6
Byakangelicol SCHEMBL21986509 0.78 KDM4E (0.67) RECQLMAOACYP3A4CYP1A2CYP2D6
Byakangelicol SCHEMBL28985145 0.78 KDM4E (0.67) RECQLMAOACYP3A4CYP1A2CYP2D6
Byakangelicol SCHEMBL30211376 0.78 KDM4E (0.67) RECQLMAOACYP3A4CYP1A2CYP2D6
Byakangelicol SCHEMBL30117221 0.78 KDM4E (0.67) RECQLMAOACYP3A4CYP1A2CYP2D6
SCHEMBL18788617 0.78 MAOA (0.78) RECQLMAOACYP3A4CYP1A2CYP2D6

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-106994145-B Pharmaceutical composition for treating or alleviating autoimmune diseases, complications thereof and/or nephritis and use of active ingredient thereof 财团法人工业技术研究院 2022-05-03 — — CN claimed
CN-119733019-A Pharmaceutical composition for functional dyspepsia and preparation method and application thereof 广州王老吉药业股份有限公司 2025-04-01 — — CN disclosed
CN-117064974-B Traditional Chinese medicine composition and traditional Chinese medicine plaster for detumescence and analgesia of knee osteoarthritis and preparation method of traditional Chinese medicine plaster 广东省第二中医院(广东省中医药工程技术研究院) 2024-05-07 — — CN disclosed
CN-117064974-A Traditional Chinese medicine composition and traditional Chinese medicine plaster for detumescence and analgesia of knee osteoarthritis and preparation method of traditional Chinese medicine plaster 广东省第二中医院(广东省中医药工程技术研究院) 2023-11-17 — — CN disclosed
WO-2022109469-A1 COMPOUNDS AND METHODS TO TARGET GLUCOSE-STIMULATED PHOSPHOHISTIDINE SIGNALING AND ESOPHAGEAL CANCER GROWTH HEALTH RESEARCH, INC. (US) 2022-05-27 — — WO disclosed
CN-106994145-B Pharmaceutical composition for treating or alleviating autoimmune diseases, complications thereof and/or nephritis and use of active ingredient thereof 财团法人工业技术研究院 2022-05-03 — — CN disclosed
US-20170258865-A1 PHARMACEUTICAL COMPOSITION FOR TREATING OR ALLEVIATING AN AUTOIMMUNE DISEASE AND/OR COMPLICATION THEREOF AND/OR NEPHRITIS AND METHOD FOR TREATING OR ALLEVIATING AN AUTOIMMUNE DISEASE AND/OR COMPLICATION THEREOF AND/OR NEPHRITIS INDUSTRIAL TECHNOLOGY RESEARCH INSTITUTE (TW) 2017-09-14 — — US 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-20170258865-A1 PHARMACEUTICAL COMPOSITION FOR TREATING OR ALLEVIATING AN AUTOIMMUNE DISEASE AND/OR COMPLICATION THEREOF AND/OR NEPHRITIS AND METHOD FOR TREATING OR ALLEVIATING AN AUTOIMMUNE DISEASE AND/OR COMPLICATION THEREOF AND/OR NEPHRITIS SSB, REN, RORC RECQL 4200/4885MAOA 2014/4885CYP3A4 3336/4885

“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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