SCHEMBL4609103

SCHEMBL4609103

Cc1cc(C(=O)c2ccccc2)cc(C)c1NC(=O)C(C)(O)C(F)(F)F

nearest known ligand 0.73

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
ABCC9 O60706 11/20 0.73
ABCC8 Q09428 11/20 0.73
KCNJ11 Q14654 11/20 0.73
KCNJ8 Q15842 11/20 0.73
PDK1 Q15118 11/20 0.67
PDK2 Q15119 11/20 0.67
PDK3 Q15120 11/20 0.67
PDK4 Q16654 11/20 0.67
ABCB11 O95342 1/20 0.67

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
SCHEMBL5549859 0.84 ABCC9 (1.00) ABCC9ABCC8KCNJ11KCNJ8PDK1
SCHEMBL4609784 0.84 ABCC9 (1.00) ABCC9ABCC8KCNJ11KCNJ8PDK1
Zd-6169 SCHEMBL4261046 0.80 ABCC9 (1.00) ABCC9ABCC8KCNJ11KCNJ8PDK1
Zd-6169 SCHEMBL2123811 0.80 ABCC9 (1.00) ABCC9ABCC8KCNJ11KCNJ8PDK1
SCHEMBL6357501 0.79 PDK1 (0.80) ABCC9ABCC8KCNJ11KCNJ8PDK1
SCHEMBL4608961 0.76 ABCC9 (1.00) ABCC9ABCC8KCNJ11KCNJ8PDK1
SCHEMBL4608131 0.76 ABCC9 (1.00) ABCC9ABCC8KCNJ11KCNJ8PDK1
SCHEMBL6531866 0.76 HTT (0.44) ABCC9ABCC8KCNJ11KCNJ8PDK1
SCHEMBL4608956 0.75 PDK1 (1.00) ABCC9ABCC8KCNJ11KCNJ8PDK1
SCHEMBL4623429 0.75 ABCC9 (0.76) ABCC9ABCC8KCNJ11KCNJ8PDK1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1059927-B1 CHEMICAL COMPOUNDS AND THEIR USE TO ELEVATE PYRUVATE DEHYDROGENASE ACTIVITY ASTRAZENECA AB (SE) 2008-07-30 EP claimed
US-20070203225-A1 METHOD OF INCREASING ENDOGENOUS ADIPONECTIN PRODUCTION AND LEPTIN PRODUCTION NATIONAL INSTITUTES OF HEALTH (NIH), U.S. DEPT. OF HEALTH AND HUMAN SERVICES (DHHS), U.S. GOVERNMENT 2007-08-30 US claimed
EP-1730310-A2 A FORMULATION FOR INCREASING ENDOGENOUS ADIPONECTIN AND LEPTIN PRODUCTION THE REGENTS OF THE UNIVERSITY OF CALIFORNIA (US) 2006-12-13 EP claimed
US-20050261362-A1 Method of increasing endogenous adiponectin and leptin production THE REGENTS OF THE UNIVERSITY OF CALIFORNIA 2005-11-24 US claimed
WO-2005092040-A2 A FORMULATION FOR INCREASING ENDOGENOUS ADIPONECTIN AND LEPTIN PRODUCTION THE REGENTS OF THE UNIVERSITY OF CALIFORNIA (US) 2005-10-06 WO claimed
US-6369273-B1 ARYL ALCOHOLS OR ESTERS FOR ELEVATION OF PYRUVATE DHYDROGENASE ASTRAZENECA AB (SE) 2002-04-09 US claimed
JP-2002505293-A 2002-02-19 JP claimed
EP-1059927-A1 CHEMICAL COMPOUNDS AND THEIR USE TO ELEVATE PYRUVATE DEHYDROGENASE ACTIVITY AstraZeneca AB (SE) 2000-12-20 EP claimed
WO-1999044618-A1 CHEMICAL COMPOUNDS AND THEIR USE TO ELEVATE PYRUVATE DEHYDROGENASE ACTIVITY ASTRAZENECA AB (SE) 1999-09-10 WO claimed
US-5482969-A Certain N(4-benzoyl-2-phenyl)-3- trifluoro-2-hydroxy-propanamide derivatives ZENECA LIMITED (GB) 1996-01-09 US claimed
EP-0617010-A1 Therapeutic compounds ZENECA LIMITED (GB) 1994-09-28 EP claimed
EP-1059927-B1 CHEMICAL COMPOUNDS AND THEIR USE TO ELEVATE PYRUVATE DEHYDROGENASE ACTIVITY ASTRAZENECA AB (SE) 2008-07-30 EP disclosed
US-20070203225-A1 METHOD OF INCREASING ENDOGENOUS ADIPONECTIN PRODUCTION AND LEPTIN PRODUCTION NATIONAL INSTITUTES OF HEALTH (NIH), U.S. DEPT. OF HEALTH AND HUMAN SERVICES (DHHS), U.S. GOVERNMENT 2007-08-30 US disclosed
EP-1730310-A2 A FORMULATION FOR INCREASING ENDOGENOUS ADIPONECTIN AND LEPTIN PRODUCTION THE REGENTS OF THE UNIVERSITY OF CALIFORNIA (US) 2006-12-13 EP disclosed
US-20050261362-A1 Method of increasing endogenous adiponectin and leptin production THE REGENTS OF THE UNIVERSITY OF CALIFORNIA 2005-11-24 US disclosed
EP-1059927-A1 CHEMICAL COMPOUNDS AND THEIR USE TO ELEVATE PYRUVATE DEHYDROGENASE ACTIVITY AstraZeneca AB (SE) 2000-12-20 EP disclosed
WO-1999044618-A1 CHEMICAL COMPOUNDS AND THEIR USE TO ELEVATE PYRUVATE DEHYDROGENASE ACTIVITY ASTRAZENECA AB (SE) 1999-09-10 WO disclosed
US-5900432-A Therapeutic N-(4-benzoyl-2-methyl-phenyl)-3,3,3-trifluoro-2-hydroxy-2-methyl-propanamides ZENECA LIMITED (GB) 1999-05-04 US disclosed
US-5482969-A Certain N(4-benzoyl-2-phenyl)-3- trifluoro-2-hydroxy-propanamide derivatives ZENECA LIMITED (GB) 1996-01-09 US disclosed
EP-0617010-A1 Therapeutic compounds ZENECA LIMITED (GB) 1994-09-28 EP disclosed