SCHEMBL557704

SCHEMBL557704

O=COC(=O)CC(O)C(=O)OC=O

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
SCHEMBL6547622 0.85 SMN1; SMN2 (0.32)
SCHEMBL1032061 0.80 TDP1 (0.30)
SCHEMBL29162934 0.79
SCHEMBL23294041 0.78 TET2 (0.32)
SCHEMBL1002608 0.76
SCHEMBL8469000 0.76 TSHR (0.33)
SCHEMBL9614483 0.76 GRIK1 (0.30)
SCHEMBL23923580 0.74
SCHEMBL1506875 0.74
SCHEMBL23610187 0.74

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 19 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2008102192-A2 CONTROLLED RELEASE PHARMACEUTICAL COMPOSITIONS EGIS GYÓGYSZERGYÁR Nyilvánosan Müködö Részvénytársaság (HU) 2008-08-28 WO claimed
EP-0114199-B1 GALENIC FORM OF AMITRIPTYLOXIDE, AND PROCESS FOR ITS PREPARATION A. Nattermann & Cie. GmbH (DE) 1988-01-07 EP claimed
EP-3906923-A1 COMPOSITION AND METHOD FOR TREATING COVID-19 WITH ISOQUINOLINE ALKALOID Phytobiotics Futterzusatzstoffe GmbH (DE) 2021-11-10 EP disclosed
CN-108522784-B Method for promoting deamidation and modifying wheat protein by organic acid type natural eutectic solvent 福州大学 2021-07-13 CN disclosed
CN-108463207-A composition for treating hair 欧莱雅 2018-08-28 CN disclosed
US-8110212-B2 Bioactive thermogelling polymer systems and methods of their use DREXEL UNIVERSITY (US) 2012-02-07 US disclosed
US-20110178239-A1 USE OF SUBSTITUTED 2-ARYL-2-ALKYL-1,3-PROPANEDIOLS OR SUBSTITUTED 2-CYCLOHEXYL-2-ALKYL-1,3-PROPANEDIOLS FOR MANUFACTURING POLYMERS BASF SE (DE) 2011-07-21 US disclosed
US-20110144259-A1 USE OF 1,1-DIMETHYLOL CYCLOALKANES OR 1,1-DIMETHYLOL CYCLOALKENES FOR THE PRODUCTION OF POLYMERS BASF SE (DE) 2011-06-16 US disclosed
US-20110130514-A1 USE OF A C11 DIOL OR C11 DIOL MIXTURE FOR PRODUCING POLYMERS BASF SE (DE) 2011-06-02 US disclosed
US-20110124809-A1 USE OF 2-ISOPROPYL-2-ALKYL-1,3-PROPANEDIOLS FOR PREPARING POLYMERS BASF SE (DE) 2011-05-26 US disclosed
US-20110040030-A1 USE OF A CYCLOHEXANE DIOL MIXTURE FOR MANUFACTURING POLYMERS BASF SE (DE) 2011-02-17 US disclosed
US-7112346-B2 Method of inducing malolactic fermentation in wine or fruit juice by direct inoculation with a non-activated started culture CHR. HANSEN A/S (DK) 2006-09-26 US disclosed
US-20030203069-A1 METHOD OF INDUCING MALOLACTIC FERMENTATION IN WINE OR FRUIT JUICE BY DIRECT INOCULATION WITH A NON-ACTIVATED STARTER CULTURE CHR. HANSEN A/S (DK) 2003-10-30 US disclosed
EP-1164867-A4 CHROMIUM-CARBOXYLIC ACID FEED SUPPLEMENT THOMPSON LEIF H (US) 2003-05-21 EP disclosed
EP-1164867-A1 CHROMIUM-CARBOXYLIC ACID FEED SUPPLEMENT Thompson, Leif H. (US) 2002-01-02 EP disclosed
US-6139881-A Chromium-carboxylic acid feed supplement THOMPSON ANIMAL SYSTEMS, INC. (US) 2000-10-31 US disclosed
WO-2000047061-A1 CHROMIUM-CARBOXYLIC ACID FEED SUPPLEMENT THOMPSON LEIF H (US) 2000-08-17 WO disclosed
CN-1081877-A Spheronization process with charged resins MERCK & CO INC (US) 1994-02-16 CN disclosed
US-5077209-A Increase nitrogen fixing in plants NATIONAL DEVELOPMENT CORPORATION (IE) 1991-12-31 US disclosed