SCHEMBL4385421

SCHEMBL4385421

CC[C@H](C)[C@H](N)C(=O)OC(=O)CC[C@H](N)C(=O)O

nearest known ligand 0.43

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ SLC1A1 P43005 4/20 0.43
▸ SLC1A3 P43003 3/20 0.43
▸ SLC1A2 P43004 3/20 0.43
▸ GRIK1 P39086 2/20 0.43
▸ GRIK2 Q13002 2/20 0.43
▸ GRM8 O00222 1/20 0.43
▸ GRM6 O15303 1/20 0.43
▸ GRIN2D O15399 1/20 0.43
▸ GRIN3B O60391 1/20 0.43
▸ GSR P00390 1/20 0.43
▸ CYP1A2 P05177 1/20 0.43
▸ GRM5 P41594 1/20 0.43
▸ GRIA1 P42261 1/20 0.43
▸ GRIA2 P42262 1/20 0.43
▸ GRIA3 P42263 1/20 0.43
▸ GRIA4 P48058 1/20 0.43
▸ GRIN1 Q05586 1/20 0.43
▸ GRIN2A Q12879 1/20 0.43
▸ GRIK3 Q13003 1/20 0.43
▸ GRIN2B Q13224 1/20 0.43

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
SCHEMBL1537407 0.89 DPP4 (0.35) SLC1A1DPP4DPP8DPP9
SCHEMBL109454 0.85 SLC1A1 (0.47) SLC1A1SLC1A3SLC1A2GRIK1GRIK2
SCHEMBL27903520 0.85 SLC1A1 (0.47) SLC1A1SLC1A3SLC1A2GRIK1GRIK2
SCHEMBL542821 0.85 DPP4 (0.41) DPP4DPP8DPP9
SCHEMBL5165368 0.84 GRIK1 (0.42) SLC1A1SLC1A3SLC1A2GRIK1GRIK2
SCHEMBL839696 0.83 SLC1A1 (0.48) SLC1A1SLC1A3SLC1A2GRIK1GRIK2
SCHEMBL1444867 0.82 SLC1A1 (0.50) SLC1A1SLC1A3SLC1A2GRIK1GRIK2
SCHEMBL598472 0.82 ALDH1A1 (0.50) ALOX15DPP4DPP8DPP9
SCHEMBL13324435 0.82 ALDH1A1 (0.50) ALOX15DPP4DPP8DPP9
SCHEMBL27909404 0.80 SLC1A1 (0.48) SLC1A1SLC1A3SLC1A2GRIK1GRIK2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-10175233-B2 Biomarkers for cardiovascular diseases and methods using the same METABOLON, INC. (US) 2019-01-08 — — US disclosed
US-20160178620-A1 Biomarkers for Pre-Diabetes, Cardiovascular Diseases, and other Metabolic-Syndrome Related Disorders and Methods Using the Same METABOLON, INC. 2016-06-23 — — US disclosed
US-9250225-B2 Biomarkers for insulin resistance and methods using the same METABOLON, INC. (US) 2016-02-02 — — US disclosed
US-20150005195-A1 Biomarkers for Pre-Diabetes, Cardiovascular Diseases, and Other Metabolic-Syndrome Related Disorders and Methods Using the Same METABOLON, INC. 2015-01-01 — — US disclosed
US-8809008-B2 Biomarkers for impaired glucose tolerance and methods using the same METABOLON, INC. (US) 2014-08-19 — — US disclosed
US-20130338031-A1 Biomarkers for Pre-Diabetes, Cardiovascular Diseases, and Other Metabolic-Syndrome Related Disorders and Methods Using the Same METABOLON, INC. 2013-12-19 — — US disclosed
WO-2013171586-A2 METABOLITE BIOMARKERS FOR STAGING COLORECTAL CANCER UTI LIMITED PARTNERSHIP (CA) 2013-11-21 — — WO disclosed
EP-2164977-B1 BIOMARKERS FOR PRE-DIABETES AND METHODS USING THE SAME METABOLON INC (US) 2013-10-30 — — EP disclosed
US-8546098-B2 Biomarkers for monitoring insulin resistance and methods using the same METABOLON, INC. (US) 2013-10-01 — — US disclosed
US-20120208215-A1 Biomarkers for Pre-Diabetes, Cardiovascular Diseases, and Other Metabolic-Syndrome Related Disorders and Methods Using the Same METABOLON, INC. (US) 2012-08-16 — — US disclosed
US-8187830-B2 Method for determining insulin sensitivity with biomarkers METABOLON, INC. (US) 2012-05-29 — — US disclosed
US-20090155826-A1 Biomarkers for pre-diabetes, cardiovascular diseases, and other metabolic-syndrome related disorders and methods using the same METABOLON, INC. (US) 2009-06-18 — — US disclosed
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