SCHEMBL842522

SCHEMBL842522

CC(=O)COCO

nearest known ligand 0.00

⚠ Novel chemotype — no close known analogue (best Tanimoto < 0.3). Unexplored chemical space relative to ChEMBL.

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
SCHEMBL18768943 0.86 CES2 (0.52)
SCHEMBL137776 0.83
SCHEMBL15327803 0.81 CES2 (0.46)
Water SCHEMBL7571126 0.80 CES2 (0.50)
Methyl Alcohol SCHEMBL4478987 0.80 CES2 (0.50)
SCHEMBL29866183 0.80 CES2 (0.50)
Water SCHEMBL10891347 0.80 CES2 (0.50)
SCHEMBL12572583 0.78 CES2 (0.48)
SCHEMBL11065093 0.78 CES2 (0.61)
Acetic Acid SCHEMBL11150462 0.77 TSHR (0.39)

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-103483410-B Xanthoceraside preparation method UNIV SHENYANG PHARMACEUTICAL 2015-06-24 CN claimed
CN-103483410-A Xanthoceraside preparation method UNIV SHENYANG PHARMACEUTICAL 2014-01-01 CN claimed
CN-102321130-A Preparation method of picein NANJING SORUN HERBAL TECH DEV 2012-01-18 CN claimed
CN-102010457-A Method for preparing raddeanin A NANJING ZELANG AGRI DEV CO LTD 2011-04-13 CN claimed
CN-114832040-A A Chinese medicinal composition for treating gynecological inflammation, and its preparation method 诸暨市黄花医卫科技部 2022-08-02 CN disclosed
CN-114246922-A Sheep feed additive capable of expelling parasites and purging intense heat and preparation method thereof 内蒙古自治区农牧业科学院 2022-03-29 CN disclosed
CN-107936265-B Method for extracting plant condensed tannin polymer 深圳大学 2020-11-10 CN disclosed
CN-103483410-B Xanthoceraside preparation method UNIV SHENYANG PHARMACEUTICAL 2015-06-24 CN disclosed
CN-103483410-A Xanthoceraside preparation method UNIV SHENYANG PHARMACEUTICAL 2014-01-01 CN disclosed
CN-101790505-B Method for reducing methanol in recycle streams in bisphenol A production processes DOW WOLFF CELLULOSICS GMBH 2013-12-11 CN disclosed
CN-102113961-B Preparation method of AM (Asymmetric Membrane) osmotic pump capsule shell UNIV ZHEJIANG TECHNOLOGY 2013-11-13 CN disclosed
US-8143456-B2 Method of reducing methanol in recycle streams in bisphenol-A production process DOW GLOBAL TECHNOLOGIES LLC (US) 2012-03-27 US disclosed
US-4439602-A Nogalamycin derivatives THE UPJOHN COMPANY (US) 1984-03-27 US disclosed
US-4318790-A Photochemical process for preparing N-demethyl-derivatives of nogalamycin THE UPJOHN COMPANY (US) 1982-03-09 US disclosed
US-4252814-A ANTIFERTILITY AGENTS, INSECTICIDES AMERICAN CYANAMID COMPANY (US) 1981-02-24 US disclosed
US-4202891-A ANOREXIGENIC AGENTS, ANTICHOLESTEROL AGENTS, INHIBITORS OF CELL GROWTH PARISH, EDWARD J. 1980-05-13 US disclosed
US-4172125-A Oil-free adjuvant compositions containing N-acetyl-muramyl-L-alanyl-D-glutamic acid and method of use AGENCE NATIONALE DE VALORISATION DE LA RECHERCHE (ANVAR) (FR) 1979-10-23 US disclosed
US-4158052-A Oil-free adjuvant compositions containing N-acetyl-muramyl-L-alanyl-D-isoglutamine AGENCE NATIONALE DE VALORISATION DE LA RECHERCHE (ANVAR) (FR) 1979-06-12 US disclosed
US-4046909-A Pyrrolidylidene, piperidylidene and hexahydroazepinylidene ureas as CNS depressants MCNEIL LABORATORIES, INCORPORATED (US) 1977-09-06 US disclosed
US-3998958-A Pyrrolidylidene, piperidylidene and hexahydroazepinylidene ureas as CNS depressants MCNEIL LABORATORIES, INCORPORATED (US) 1976-12-21 US disclosed