SCHEMBL1913403

SCHEMBL1913403

CC(O)CCC(=O)O.[CaH2]

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
SCHEMBL27394 0.97
SCHEMBL265217 0.97
SCHEMBL264824 0.97
SCHEMBL1124238 0.97 GABRP (0.59)
SCHEMBL311419 0.94
SCHEMBL11690150 0.94
Ammonia Solution, Strong SCHEMBL8829491 0.94
Methylamine SCHEMBL6691699 0.92 GABRP (0.61)
3-Hydroxybutyric Acid, (+/-)- SCHEMBL7932482 0.87 GABRP (0.50)
Levulinic Acid SCHEMBL165683 0.85 LMNA (0.64)

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-3806906-A1 NOVEL KETOGENIC COMPOUNDS, COMPOSITIONS, METHODS AND USE THEREOF Ketofibe (9211-3133 Quebec Inc.) (CA) 2021-04-21 EP disclosed
WO-2019237185-A1 NOVEL KETOGENIC COMPOUNDS, COMPOSITIONS, METHODS AND USE THEREOF KETOFIBE (9211-3133 QUEBEC INC.) (CA) 2019-12-19 WO disclosed
EP-2986163-A1 NUTRITIONAL COMPOSITIONS INCLUDING CALCIUM BETA-HYDROXY-BETA-METHYLBUTYRATE, CASEIN PHOSPHOPEPTIDE, AND PROTEIN Abbott Laboratories (US) 2016-02-24 EP disclosed
US-20160037815-A1 NUTRITIONAL COMPOSITIONS INCLUDING CALCIUM BETA-HYDROXY-BETA-METHYLBUTYRATE, CASEIN PHOSPHOPEPTIDE, AND PROTEIN ABBOTT LABORATORIES (US) 2016-02-11 US disclosed
WO-2014144048-A1 NUTRITIONAL COMPOSITIONS INCLUDING CALCIUM BETA-HYDROXY-BETA-METHYLBUTYRATE, CASEIN PHOSPHOPEPTIDE, AND PROTEIN ABBOTT LABORATORIES (US) 2014-09-18 WO disclosed
EP-2512236-A1 IMPROVED METHOD OF ADMINISTERING BETA-HYDROXY-BETA-METHYLBUTYRATE (HMB) Metabolic Technologies, Inc. (US) 2012-10-24 EP disclosed
WO-2011075741-A1 IMPROVED METHOD OF ADMINISTERING BETA-HYDROXY-BETA-METHYLBUTYRATE (HMB) METABOLIC TECHNOLOGIES, INC. (US) 2011-06-23 WO disclosed
EP-1750527-A1 COMPOSITIONS AND METHOD FOR ENHANCING THE BIOAVAILABILITY OF CALCIUM AND MAGNESIUM IN DIETARY SUPPLEMENTS AND FOOD ADDITIVES Wiley Organics, Inc. (US) 2007-02-14 EP disclosed
WO-2005096846-A1 COMPOSITION AND METHOD FOR ENHANCING THE BIOAVAILABILITY OF CALCIUM AND MAGNESIUM IN DIETARY SUPPLEMENTS AND FOOD ADDITIVES WILEY ORGANICS, INC. (US) 2005-10-20 WO disclosed
US-20040220266-A1 Composition and method for enhancing the bioavailability of calcium and magnesium in dietary supplements and food additives WILEY ORGANICS, INC. 2004-11-04 US disclosed
US-20040048925-A1 Composition and method for enhancing the bioavailability of calcium and magnesium in dietary supplements and food additives WILEY ORGANICS, INC. 2004-03-11 US disclosed