SCHEMBL259537

SCHEMBL259537

C[C@]12CC[C@@H]3c4ccc(O)cc4CC[C@H]3[C@@]13CC[C@]2(O)[C@H](O)C3

nearest known ligand 0.52

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ESR1 P03372 9/20 0.52
ESR2 Q92731 9/20 0.52
SHBG P04278 5/20 0.52
HSD17B10 Q99714 4/20 0.52
LMNA P02545 4/20 0.52
STS P08842 4/20 0.52
PGR P06401 4/20 0.52
AR P10275 4/20 0.52
SLC6A4 P31645 4/20 0.52
SLC6A3 Q01959 4/20 0.52
CYP3A4 P08684 4/20 0.52
HIF1A Q16665 3/20 0.52
SERPINA6 P08185 3/20 0.52
SNCA P37840 3/20 0.52
HTR2B P41595 3/20 0.52
NR3C1 P04150 3/20 0.52
TSHR P16473 2/20 0.52
CYP1A2 P05177 2/20 0.52
AKR1B10 O60218 2/20 0.52
MAPT P10636 2/20 0.52

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
SCHEMBL9146993 1.00 ESR1 (0.52) ESR1ESR2SHBGHSD17B10LMNA
SCHEMBL8959365 1.00 ESR1 (0.52) ESR1ESR2SHBGHSD17B10LMNA
SCHEMBL8959381 1.00 ESR1 (0.52) ESR1ESR2SHBGHSD17B10LMNA
SCHEMBL9725110 0.90 ESR1 (0.48) ESR1ESR2SHBGHSD17B10LMNA
SCHEMBL9725182 0.90 ESR1 (0.48) ESR1ESR2SHBGHSD17B10LMNA
SCHEMBL8959377 0.87 LMNA (0.55) ESR1ESR2HSD17B10LMNASTS
SCHEMBL8959370 0.87 LMNA (0.55) ESR1ESR2HSD17B10LMNASTS
SCHEMBL9148144 0.87 LMNA (0.55) ESR1ESR2HSD17B10LMNASTS
SCHEMBL9725143 0.86 ESR1 (0.49) ESR1ESR2SHBGHSD17B10LMNA
SCHEMBL9144814 0.83 LMNA (0.58) ESR1SHBGHSD17B10LMNASTS

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-116444570-A Preparation method of cyclotri-o-dimethylhydroquinone hydrocarbon derivative eutectic material and application of cyclotri-o-dimethylhydroquinone hydrocarbon derivative eutectic material in molecular eutectic and structure identification 南京晶立得科技有限公司 2023-07-18 CN claimed
CN-110156628-B Cyclotriol derivative and preparation method and application thereof 暨南大学 2022-05-17 CN claimed
EP-0655916-B1 TRANSDERMAL APPLICATION AGENT CONTAINING 3-KETO-DESOGESTREL SCHERING AG (DE) 1998-02-04 EP claimed
US-5529993-A UROGENITAL DISORDERS; CONTRACEPTIVES SCHERING AKTIENGESELLSCHAFT (DE) 1996-06-25 US claimed
EP-0430386-B1 14Alpha, 17alpha bridged 16-hydroxyestratrienes SCHERING AG (DE) 1995-05-03 EP claimed
EP-0430386-A1 14Alpha, 17alpha bridged 16-hydroxyestratrienes SCHERING AKTIENGESELLSCHAFT (DE) 1991-06-05 EP claimed
CN-119680533-A Preparation method for preparing degradation typical olfactory catalyst by using waste zinc-carbon battery, obtained product and application 山东建筑大学 2025-03-25 CN disclosed
CN-116444570-A Preparation method of cyclotri-o-dimethylhydroquinone hydrocarbon derivative eutectic material and application of cyclotri-o-dimethylhydroquinone hydrocarbon derivative eutectic material in molecular eutectic and structure identification 南京晶立得科技有限公司 2023-07-18 CN disclosed
CN-116444570-A Preparation method of cyclotri-o-dimethylhydroquinone hydrocarbon derivative eutectic material and application of cyclotri-o-dimethylhydroquinone hydrocarbon derivative eutectic material in molecular eutectic and structure identification 南京晶立得科技有限公司 2023-07-18 CN disclosed
CN-116444570-A Preparation method of cyclotri-o-dimethylhydroquinone hydrocarbon derivative eutectic material and application of cyclotri-o-dimethylhydroquinone hydrocarbon derivative eutectic material in molecular eutectic and structure identification 南京晶立得科技有限公司 2023-07-18 CN disclosed
CN-110144757-B Formaldehyde-free filter paper and special binder thereof 江苏艾科赛特新材料有限公司 2023-04-11 CN disclosed
CN-115837036-A Application of hermetia illucens extract in preparation of parasite insecticide for aquatic animals 浙江省淡水水产研究所 2023-03-24 CN disclosed
CN-110156628-B Cyclotriol derivative and preparation method and application thereof 暨南大学 2022-05-17 CN disclosed
US-5676968-A CONTAINING PENETRATION PROMOTER, ACTIVE MATERIAL AND ADHESIVE SCHERING AKTIENGESELLSCHAFT (DE) 1997-10-14 US disclosed
EP-0610357-B1 TRANSDERMAL THERAPEUTIC SYSTEMS CONTAINING CRYSTALLIZATION INHIBITORS SCHERING AG (DE) 1997-09-17 EP disclosed
EP-0664811-B1 GESTAGENICALLY ACTIVE 19,11-BRIDGED 4-ESTRENES SCHERING AG (DE) 1997-08-13 EP disclosed
US-5529993-A UROGENITAL DISORDERS; CONTRACEPTIVES SCHERING AKTIENGESELLSCHAFT (DE) 1996-06-25 US disclosed
US-5523298-A USED TO INDUCE LABOR, ABORTION, MENSTRUATION, AND AGAINSTS HORMONAL IRREGULARITIES SCHERING AKTIENGESELLSCHAFT (DE) 1996-06-04 US disclosed
EP-0430386-B1 14Alpha, 17alpha bridged 16-hydroxyestratrienes SCHERING AG (DE) 1995-05-03 EP disclosed
EP-0430386-A1 14Alpha, 17alpha bridged 16-hydroxyestratrienes SCHERING AKTIENGESELLSCHAFT (DE) 1991-06-05 EP disclosed