SCHEMBL14941191

SCHEMBL14941191

CC(OS(=O)(=O)O)[C@H]1CC[C@H]2[C@@H]3CC[C@H]4C[C@H](OS(=O)(=O)O)CC[C@]4(C)[C@H]3CC[C@]12C

nearest known ligand 0.83

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
GRIN1 Q05586 13/20 0.83
GRIN2B Q13224 13/20 0.83
ABCC4 O15439 3/20 0.69
VDR P11473 1/20 0.69
GRIN2D O15399 2/20 0.69
GRIN2A Q12879 2/20 0.69
GRIN2C Q14957 2/20 0.69
ABCC1 P33527 1/20 0.61
GPBAR1 Q8TDU6 1/20 0.61

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
SCHEMBL7011421 1.00 GRIN1 (0.83) GRIN1GRIN2BABCC4VDRGRIN2D
SCHEMBL14941193 1.00 GRIN1 (0.83) GRIN1GRIN2BABCC4VDRGRIN2D
SCHEMBL15921398 1.00 GRIN1 (0.83) GRIN1GRIN2BABCC4VDRGRIN2D
SCHEMBL14941061 1.00 GRIN1 (0.83) GRIN1GRIN2BABCC4VDRGRIN2D
SCHEMBL15921397 1.00 GRIN1 (0.83) GRIN1GRIN2BABCC4VDRGRIN2D
SCHEMBL19253197 0.91 GRIN1 (1.00) GRIN1GRIN2BABCC4VDRGRIN2D
SCHEMBL15796049 0.89 GRIN1 (0.87) GRIN1GRIN2BABCC4VDRGRIN2D
SCHEMBL2392478 0.89 GRIN1 (0.87) GRIN1GRIN2BABCC4VDRGRIN2D
SCHEMBL15994082 0.89 GRIN1 (0.87) GRIN1GRIN2BABCC4VDRGRIN2D
SCHEMBL2392476 0.89 GRIN1 (0.87) GRIN1GRIN2BABCC4VDRGRIN2D

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-3321686-B1 BIOMARKERS RELATED TO INSULIN RESISTANCE PROGRESSION AND METHODS USING THE SAME METABOLON INC (US) 2024-03-13 EP disclosed
US-20180203021-A1 Biomarkers Related to Insulin Resistance Progression and Methods Using the Same METABOLON, INC. 2018-07-19 US disclosed
EP-3321686-A1 BIOMARKERS RELATED TO INSULIN RESISTANCE PROGRESSION AND METHODS USING THE SAME Metabolon, Inc. (US) 2018-05-16 EP disclosed
EP-2951313-B1 BIOMARKERS RELATED TO INSULIN RESISTANCE PROGRESSION AND METHODS USING THE SAME METABOLON INC (US) 2018-03-07 EP disclosed
EP-2951313-A1 BIOMARKERS RELATED TO INSULIN RESISTANCE PROGRESSION AND METHODS USING THE SAME Metabolon, Inc. (US) 2015-12-09 EP disclosed
US-20140296134-A1 METHODS AND USES FOR METABOLIC PROFILING FOR CLOSTRIDIUM DIFFICILE INFECTION THE BOARD OF REGENTS OF THE UNIVERSITY OF TEXAS SYSTEM (US) 2014-10-02 US disclosed
EP-2776829-A1 METHODS AND USES FOR METABOLIC PROFILING FOR CLOSTRIDIUM DIFFICILE INFECTION The Board of Regents of The University of Texas System (US) 2014-09-17 EP disclosed
WO-2014120449-A1 BIOMARKERS RELATED TO INSULIN RESISTANCE PROGRESSION AND METHODS USING THE SAME METABOLON, INC. (US) 2014-08-07 WO disclosed
US-20140156573-A1 METHODS FOR GENERATING PREDICTIVE MODELS FOR EPITHELIAL OVARIAN CANCER AND METHODS FOR IDENTIFYING EOC THE RESEARCH FOUNDATION OF STATE UNIVERSITY OF NEW YORK (US) 2014-06-05 US disclosed
WO-2013188333-A1 BIOMARKERS RELATED TO NEPHROTOXICITY AND METHODS USING THE SAME METABOLON, INC. (US) 2013-12-19 WO disclosed
WO-2013070962-A1 METHODS AND USES FOR METABOLIC PROFILING FOR CLOSTRIDIUM DIFFICILE INFECTION THE BOARD OF REGENTS OF THE UNIVERSITY OF TEXAS SYSTEM (US) 2013-05-16 WO disclosed