SCHEMBL9570737

SCHEMBL9570737

[O][C@H]1[C@H](O)COC[C@@H]1O

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
SCHEMBL7526985 1.00
SCHEMBL29016131 0.78 THRB (0.41)
SCHEMBL196429 0.78
SCHEMBL209943 0.78
SCHEMBL209944 0.78
SCHEMBL23284422 0.78
SCHEMBL13660720 0.78
SCHEMBL209942 0.78
SCHEMBL2571471 0.78
SCHEMBL846334 0.74 FUCA1 (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 15 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
JP-5292989-A None JP disclosed
CN-104297402-B The HPLC content assaying method of adenosine in plantain seed JILIN UNIVERSITY (CN) 2016-01-20 CN disclosed
CN-104297402-A HPLC content determination method for adenosine in semen plantaginis UNIV JILIN 2015-01-21 CN disclosed
CN-101875686-B Steroid saponin compounds and preparation method and application thereof UNIV TSINGHUA GRADUATE SCHOOL 2012-04-18 CN disclosed
CN-102327330-A Method for preparing anemone davidii total saponin and application thereof to preparation of medicament JIANGXI HERBFINE HI TECH CO 2012-01-25 CN disclosed
CN-102274272-A Triterpene compositions and methods for use thereof 2011-12-14 CN disclosed
CN-101926900-B Pediluvium composition and preparing method thereof ZIJIANG SHAO 2011-10-26 CN disclosed
CN-101926900-A Pediluvium composition and preparing method thereof ZIJIANG SHAO 2010-12-29 CN disclosed
CN-101875686-A Steroid saponin compounds and preparation method and application thereof UNIV TSINGHUA GRADUATE SCHOOL 2010-11-03 CN disclosed
CN-100584856-C The purposes of a kind of Hederagenin, its preparation method and preparation antitumor drug thereof UNIV CHINA PHARMA 2010-01-27 CN disclosed
CN-101528209-A Oleanorane triterpene saponin compounds effective in treating dementia and Mild Cognitive Impairment (MCI) and improving cognitive function SK CHEMICAL CO LTD 2009-09-09 CN disclosed
CN-101157714-A Hedera helix saponin, preparation method and antineoplastic use thereof UNIV CHINA PHARMA (CN) 2008-04-09 CN disclosed
CN-1496255-A Inhibition of NF-KB by triterpene compositions �������о�����չ˽�����޹�˾ 2004-05-12 CN disclosed
CN-1307473-A Triterpene compositions and methods of their use RES DEV FOUDATION (US) 2001-08-08 CN disclosed
JP-H05292989-A PRODUCTION OF CYANIDINE 3-O-(BETA-D-XYLOPYRANOSYL@(3754/24)1 - 2) BETA-D-GALACTOPYRANOSIDE) TONEN CORP 1993-11-09 JP disclosed