SCHEMBL7442811

SCHEMBL7442811

Oc1ccc2c(c1)CCC2O

nearest known ligand 0.54

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ESR2 Q92731 12/20 0.54
ESR1 P03372 12/20 0.54
CYP19A1 P11511 1/20 0.49
GRIN1 Q05586 1/20 0.48
GRIN2B Q13224 1/20 0.48
DRD2 P14416 1/20 0.47
DRD3 P35462 1/20 0.47
OPRK1 P41145 1/20 0.47
HSD17B10 Q99714 3/20 0.47
LMNA P02545 2/20 0.47
TSHR P16473 2/20 0.47
CYP1A2 P05177 1/20 0.47
CYP2C9 P11712 1/20 0.47
CYP2C19 P33261 1/20 0.47
HIF1A Q16665 1/20 0.47
MEN1 O00255 1/20 0.47
KMT2A Q03164 1/20 0.47
SLC22A1 O15245 1/20 0.47
AKR1B10 O60218 1/20 0.47
SLC22A3 O75751 1/20 0.47

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
SCHEMBL7913405 0.88 ESR2 (0.57) ESR2ESR1CYP19A1GRIN1GRIN2B
SCHEMBL19116602 0.85 GFRA3 (0.51) ESR2ESR1MEN1KMT2APGR
SCHEMBL8348394 0.83 ESR1 (0.54) ESR2ESR1CYP19A1DRD2DRD3
SCHEMBL28033988 0.83 ESR1 (0.54) ESR2ESR1CYP19A1DRD2DRD3
SCHEMBL9281232 0.82 MAP3K14 (0.51) TSHRPGRSLC6A4HTR2B
SCHEMBL29959450 0.82 MAP3K14 (0.51) TSHRPGRSLC6A4HTR2B
SCHEMBL1693312 0.82 MAP3K14 (0.51) TSHRPGRSLC6A4HTR2B
SCHEMBL15909359 0.82 MAP3K14 (0.51) TSHRPGRSLC6A4HTR2B
SCHEMBL8034552 0.78 ESR1 (0.53) ESR2ESR1CYP19A1DRD2DRD3
SCHEMBL3202300 0.78 SRD5A1 (0.45) PGRSLC6A4

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
WO-1995015325-A1 IMIDAZOLYL-ALKENOIC ACIDS SMITHKLINE BEECHAM CORPORATION (US) 1995-06-08 WO claimed
CN-116234546-A GPX4 inhibitors, pharmaceutical compositions thereof and their use in the treatment of GPX4 mediated diseases 嘉兴优博生物技术有限公司 2023-06-06 CN disclosed
EP-3082786-B1 ANTIDIABETIC SUBSTITUTED HETEROARYL COMPOUNDS MERCK SHARP & DOHME (US) 2021-10-27 EP disclosed
CN-108292064-A Alignment films and liquid crystal display device 夏普株式会社 2018-07-17 CN disclosed
CN-104903363-B Monomer, liquid-crystal composition, the manufacture method of liquid crystal display device and liquid crystal display device 夏普株式会社 2018-05-04 CN disclosed
CN-107615144-A Liquid crystal display device and alignment films 夏普株式会社 2018-01-19 CN disclosed
CN-107037635-A The manufacture method of liquid crystal display device 夏普株式会社 2017-08-11 CN disclosed
CN-106873248-A Liquid crystal display panel and liquid crystal display device 夏普株式会社 2017-06-20 CN disclosed
CN-106662767-A Liquid-crystal display 夏普株式会社 2017-05-10 CN disclosed
CN-103765305-B Liquid crystal display panel and liquid crystal display device 夏普株式会社 2017-04-12 CN disclosed
CN-103919705-A Composite hair dyeing powder prepared from indigofera tinctoria plant ZHANG XIANWEN 2014-07-16 CN disclosed
US-5395847-A Angiotensin II receptor antagonists; useful in regulating hypertension, treatment of congestive heart failure, renal failure, and glaucoma SMITHKLINE BEECHAM CORPORATION (US) 1995-03-07 US disclosed
US-4265892-A Cephalosporins having an α-acylaminoacetic acid side chain CIBA-GEIGY CORPORATION (US) 1981-05-05 US disclosed
US-4202900-A Derivatives of penam-3-carboxylic acid and a pharmaceutical composition containing the same CIBA-GEIGY CORPORATION (US) 1980-05-13 US disclosed
US-4154831-A Cephalosporins having an α-acylaminoacetic acid side chain CIBA-GEIGY CORPORATION (US) 1979-05-15 US disclosed
US-4067979-A Cephalosporins having an α-acyloxyacetic acid side chain CIBA-GEIGY CORPORATION (US) 1978-01-10 US disclosed
US-4041161-A ANTIBIOTICS CIBA-GEIGY CORPORATION (US) 1977-08-09 US disclosed
US-4015000-A 6-Acylamino-penam-3-carboxylic and 7-acylamino-3-cephem-4-carboxylic acids CIBA-GEIGY CORPORATION (US) 1977-03-29 US disclosed
US-4012524-A DIURETICS, SALURETICS, HYPOURICEMICS, HYPOTENSIVES, ANTIEDEMICS MERCK & CO., INC. (US) 1977-03-15 US disclosed
US-4012524-A DIURETICS, SALURETICS, HYPOURICEMICS, HYPOTENSIVES, ANTIEDEMICS MERCK & CO., INC. (US) 1977-03-15 US disclosed