SCHEMBL225052

SCHEMBL225052

C[C@]12CC[C@@H]3c4cc(O)c(O)cc4CC[C@H]3[C@@H]1CC[C@@H]2O

nearest known ligand 1.00 ✓ in ChEMBL — recovers established targets

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ESR1 P03372 5/20 1.00
ESR2 Q92731 4/20 1.00
MEN1 O00255 3/20 1.00
LMNA P02545 3/20 1.00
KMT2A Q03164 3/20 1.00
GAA P10253 2/20 1.00
MAPT P10636 2/20 1.00
KDM4E B2RXH2 1/20 1.00
POLB P06746 1/20 1.00
G6PD P11413 1/20 1.00
PKM P14618 1/20 1.00
MAPK1 P28482 1/20 1.00
RAB9A P51151 1/20 1.00
DAB2IP Q5VWQ8 1/20 1.00
ADCY10 Q96PN6 1/20 1.00
TDP1 Q9NUW8 1/20 1.00
CYP19A1 P11511 5/20 0.84
SHBG P04278 2/20 0.82
HSD17B10 Q99714 4/20 0.78
CYP1A2 P05177 3/20 0.78

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
SCHEMBL12027476 1.00 ESR1 (1.00) ESR1ESR2MEN1LMNAKMT2A
SCHEMBL6010005 1.00 ESR1 (1.00) ESR1ESR2MEN1LMNAKMT2A
SCHEMBL13123058 1.00 ESR1 (1.00) ESR1ESR2MEN1LMNAKMT2A
SCHEMBL29565170 1.00 ESR1 (1.00) ESR1ESR2MEN1LMNAKMT2A
SCHEMBL15491309 1.00 ESR1 (1.00) ESR1ESR2MEN1LMNAKMT2A
SCHEMBL225053 1.00 ESR1 (1.00) ESR1ESR2MEN1LMNAKMT2A
SCHEMBL4206797 0.91 CYP19A1 (1.00) ESR1ESR2MEN1LMNAKMT2A
SCHEMBL2617357 0.91 CYP19A1 (1.00) ESR1ESR2MEN1LMNAKMT2A
SCHEMBL3868013 0.91 CYP19A1 (1.00) ESR1ESR2MEN1LMNAKMT2A
SCHEMBL5025553 0.91 CYP19A1 (1.00) ESR1ESR2MEN1LMNAKMT2A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-121577774-A Non-alcoholic fatty liver biomarker composition and application thereof 西安交通大学医学院第一附属医院 2026-02-27 CN claimed
WO-2024259428-A2 ESTROGENIC COMPOUNDS AND FORMULATIONS FOR GESTATION-RELATED COMPLICATIONS THE BOARD OF TRUSTEES OF THE LELAND STANFORD JUNIOR UNIVERSITY (US) 2024-12-19 WO claimed
CN-117789993-B Establishment and application of gastric cancer prediction model based on tongue fur metabolite 浙江省肿瘤医院 2024-06-11 CN claimed
CN-117789993-A Establishment and application of gastric cancer prediction model based on tongue fur metabolite 浙江省肿瘤医院 2024-03-29 CN claimed
US-20240093191-A1 COMPOSITIONS AND METHODS FOR TREATING DISEASE ASSOCIATED WITH DUX4 OVEREXPRESSION RESEARCH INSTITUTE AT NATIONWIDE CHILDREN'S HOSPITAL (US) 2024-03-21 US claimed
EP-4288539-A1 COMPOSITIONS AND METHODS FOR TREATING DISEASE ASSOCIATED WITH DUX4 OVEREXPRESSION Research Institute at Nationwide Children's Hospital (US) 2023-12-13 EP claimed
WO-2023234790-A1 APPLICATION OF HYDROGEN PEROXIDE AND 17β-ESTRADIOL AND ITS METABOLITES AS BIOMARKERS IN A METHOD OF DIAGNOSING NEURODEGENERATIVE DISEASES IN VITRO GDANSKI UNIWERSYTET MEDYCZNY (PL) 2023-12-07 WO claimed
US-20230210870-A1 METHODS OF TREATING FEMALE HEALTH CONDITIONS RELATED TO SEX HORMONES ELIEM THERAPEUTICS INC (US) 2023-07-06 US claimed
EP-4161530-A1 METHODS OF TREATING FEMALE HEALTH CONDITIONS RELATED TO SEX HORMONES Eliem Therapeutics (UK) Ltd (GB) 2023-04-12 EP claimed
EP-4021369-A1 MEDICAL DEVICES FOR CONTINUOUS DELIVERY OF THERAPEUTIC AGENTS Forman, Mervyn B. (US) 2022-07-06 EP claimed
EP-0923376-A4 TREATMENT OF ASTHMA AND AIRWAY DISEASES AMRAD OPERATIONS PTY LTD (AU) 2001-09-26 EP claimed
US-6200966-B1 FOR TREATING CHRONIC AND ACUTE INFLAMMATION OF AIRWAYS, INCLUDING ASTHMATIC CONDITIONS AMRAD OPERATIONS PTY. LTD. (AU) 2001-03-13 US claimed
WO-2001014405-A2 METHODS OF OBTAINING 2-METHOXYESTRADIOL OF HIGH PURITY ENTREMED, INC. (US) 2001-03-01 WO claimed
JP-2000507923-A 2000-06-27 JP claimed
US-5962445-A Treatment of asthma and airway diseases AMRAD OPERATIONS PTY LTD. (AU) 1999-10-05 US claimed
EP-0923376-A1 TREATMENT OF ASTHMA AND AIRWAY DISEASES Amrad Operations Pty.,Ltd. (AU) 1999-06-23 EP claimed
WO-1999001142-A1 PHARMACEUTICAL COMPOSITIONS COMPRISING AN ANGIOSTATIC STEROID COMBINED WITH A HYALURONAN HYAL PHARMACEUTICAL CORPORATION (CA) 1999-01-14 WO claimed
WO-1997042958-A1 TREATMENT OF ASTHMA AND AIRWAY DISEASES AMRAD OPERATIONS PTY. LTD. (AU) 1997-11-20 WO claimed
US-5521168-A TREATING GLAUCOMA ALCON LABORATORIES, INC. (US) 1996-05-28 US claimed
US-4427669-A 2-HYDROXY-OR 4-HYDROXYESTRADIOL THE BOARD OF REGENTS OF THE UNIVERSITY OF NEBRASKA (US) 1984-01-24 US claimed

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-20230210870-A1 METHODS OF TREATING FEMALE HEALTH CONDITIONS RELATED TO SEX HORMONES SHBG, CYP17A1, NR5A1 ESR1 37/4885ESR2 23/4885MEN1 1071/4885

“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.