SCHEMBL653302

SCHEMBL653302

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

nearest known ligand 0.37

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
CYP2C19 P33261 2/20 0.37
HIF1A Q16665 2/20 0.37
CYP2D6 P10635 1/20 0.37
TSHR P16473 1/20 0.37
CPT2 P23786 1/20 0.35
ACLY P53396 1/20 0.35
TP53 P04637 1/20 0.33
ALDH1A1 P00352 1/20 0.33
HMGCR P04035 1/20 0.33
CHRM1 P11229 1/20 0.33
TBXA2R P21731 1/20 0.33
ADRA1A P35348 1/20 0.33

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
SCHEMBL2178222 0.98 CYP2D6 (0.35) CYP2C19HIF1ACYP2D6TSHRCPT2
SCHEMBL28463865 0.98 CYP2D6 (0.35) CYP2C19HIF1ACYP2D6TSHRCPT2
SCHEMBL28501051 0.98 CYP2D6 (0.35) CYP2C19HIF1ACYP2D6TSHRCPT2
SCHEMBL28415458 0.98 CYP2D6 (0.35) CYP2C19HIF1ACYP2D6TSHRCPT2
Ammonia Solution, Strong SCHEMBL5048410 0.98 CYP2D6 (0.35) CYP2C19HIF1ACYP2D6TSHRCPT2
SCHEMBL28564581 0.98 CYP2D6 (0.35) CYP2C19HIF1ACYP2D6TSHRCPT2
SCHEMBL9387459 0.98 CYP2D6 (0.35) CYP2C19HIF1ACYP2D6TSHRCPT2
SCHEMBL2971627 0.98 CYP2D6 (0.35) CYP2C19HIF1ACYP2D6TSHRCPT2
SCHEMBL20521418 0.98 CYP2D6 (0.35) CYP2C19HIF1ACYP2D6TSHRCPT2
SCHEMBL7125983 0.98 CYP2D6 (0.35) CYP2C19HIF1ACYP2D6TSHRCPT2

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 60 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-106608912-A Aliphatic-dicarboxylic-acid-coupled EPO mimic peptide derivative and preparation method and application thereof 天津药物研究院有限公司 2017-05-03 CN claimed
US-7319032-B2 Non-sugar sweeteners for use in test devices MEDTOX (US) 2008-01-15 US claimed
EP-1833298-A1 STABLE CONCENTRATED ANTI-BACTERIAL EMULSIONS OF MONOCAPRIN IN WATER Thormar, Halldor (IS) 2007-09-19 EP claimed
WO-2006064520-A9 STABLE CONCENTRATED ANTI-BACTERIAL EMULSIONS OF MONOCAPRIN IN WATER THORMAR HALLDOR (IS) 2006-11-16 WO claimed
WO-2006064520-A1 STABLE CONCENTRATED ANTI-BACTERIAL EMULSIONS OF MONOCAPRIN IN WATER THORMAR HALLDOR (IS) 2006-06-22 WO claimed
CN-106632133-B Thiazole derivative and the preparation method and application thereof 山东大学 2019-04-16 CN disclosed
WO-2017165956-A1 METABOLOMICS ANALYSIS OF RENAL CELL CARCINOMA UTI LIMITED PARTNERSHIP (CA) 2017-10-05 WO disclosed
US-9765294-B2 Chemically defined medium for the industrial scale culture of a species of Bordetella GLAXOSMITHKLINE BIOLOGICALS S.A. (BE) 2017-09-19 US disclosed
EP-3044308-B1 A CHEMICALLY DEFINED MEDIUM FOR THE INDUSTRIAL SCALE CULTURE OF A SPECIES OF BORDETELLA GLAXOSMITHKLINE BIOLOGICALS SA (BE) 2017-08-09 EP disclosed
CN-106632133-A Novel thiazole derivatives, and preparation method and application thereof 山东大学 2017-05-10 CN disclosed
CN-106608913-A 1,2,3-tricarballylic acid coupled EPO peptoid derivative and preparation method and application thereof 天津药物研究院有限公司 2017-05-03 CN disclosed
CN-106554394-A A kind of Erythropoietin mimetic peptide and its preparation method and application 天津药物研究院有限公司 2017-04-05 CN disclosed
WO-2004105710-A1 TRANSPARENT CONDITIONING SHAMPOO COLGATE-PALMOLIVE COMPANY (US) 2004-12-09 WO disclosed
US-6743760-B1 ANIONIC SURFACTANT; SILICONE QUATERNIUM-8; LOW MOLECULAR WEIGHT GUAR GUM; POLYQUATERNIUM-10; AMPHOTERIC SURFACTANT COLGATE-PALMOLIVE COMPANY 2004-06-01 US disclosed
EP-1328165-A2 CALCIUM-SUPPLEMENTED BEVERAGES AND METHOD OF MAKING SAME PepsiCo, Inc. (US) 2003-07-23 EP disclosed
US-20020102331-A1 Calcium-supplemented beverages and method of making same PEPSICO, INC. 2002-08-01 US disclosed
WO-2002032236-A2 CALCIUM-SUPPLEMENTED BEVERAGES AND METHOD OF MAKING SAME PEPSICO, INC. (US) 2002-04-25 WO disclosed
US-5514802-A Intermediates for preparing HIV protease inhibitors ELI LILLY AND COMPANY (US) 1996-05-07 US disclosed
US-5240957-A Dopaminergic agent ASTRA LAKEMEDEL AKTEIBOLAG (SE) 1993-08-31 US disclosed
EP-0049618-B1 IMPROVEMENTS IN OR RELATING TO 2,4-DISUBSTITUTED THIAZOLE DERIVATIVES ELI LILLY AND COMPANY (US) 1985-08-14 EP disclosed