SCHEMBL7017897

SCHEMBL7017897

CCOc1nc2cccc(C(=O)OCOC(C)=O)c2n1Cc1ccc(-c2ccccc2-c2nc(=O)o[nH]2)cc1

nearest known ligand 0.61

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
AGTR2 P50052 3/20 0.59
CYP3A4 P08684 2/20 0.56
ADORA3 P0DMS8 2/20 0.56
ADRA2B P18089 2/20 0.56
SLC6A2 P23975 2/20 0.56
AGTR1 P30556 2/20 0.56
PPARG P37231 2/20 0.56
HTR2B P41595 2/20 0.56
PDE3A Q14432 2/20 0.56
ABCB11 O95342 1/20 0.56
EGFR P00533 1/20 0.56
ERBB2 P04626 1/20 0.56
CYP2C9 P11712 1/20 0.56
ADRB3 P13945 1/20 0.56
TBXAS1 P24557 1/20 0.56
HTR2C P28335 1/20 0.56
LTB4R2 Q9NPC1 1/20 0.56
NAE1 Q13564 4/20 0.48
KDM4E B2RXH2 1/20 0.48
MEN1 O00255 1/20 0.48

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
SCHEMBL7017670 0.90 AGTR2 (0.59) AGTR2CYP3A4ADORA3ADRA2BSLC6A2
SCHEMBL684035 0.89 AGTR2 (0.75) AGTR2CYP3A4ADORA3ADRA2BSLC6A2
Azilsartan SCHEMBL30604716 0.88 AGTR2 (0.68) AGTR2CYP3A4ADORA3ADRA2BSLC6A2
Azilsartan SCHEMBL284893 0.88 AGTR2 (0.68) AGTR2CYP3A4ADORA3ADRA2BSLC6A2
Azilsartan SCHEMBL7017834 0.87 AGTR2 (0.67) AGTR2CYP3A4ADORA3ADRA2BSLC6A2
Azilsartan SCHEMBL7017842 0.87 AGTR2 (0.67) AGTR2CYP3A4ADORA3ADRA2BSLC6A2
Azilsartan SCHEMBL7017839 0.86 AGTR2 (0.57) AGTR2CYP3A4ADORA3ADRA2BSLC6A2
SCHEMBL683999 0.86 AGTR2 (0.60) AGTR2CYP3A4ADORA3ADRA2BSLC6A2
Azilsartan Medoxomil SCHEMBL2129551 0.85 AGTR2 (0.81) AGTR2CYP3A4ADORA3ADRA2BSLC6A2
SCHEMBL8362116 0.84 AGTR2 (0.57) AGTR2CYP3A4ADORA3ADRA2BSLC6A2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0520423-B1 Heterocyclic compounds, their production and use as angiotensin II antagonists TAKEDA CHEMICAL INDUSTRIES LTD (JP) 2003-05-14 EP disclosed
US-6100252-A SPECIFIED COMPOUNDS INCLUDING METHYL 2-BUTYL-1-((2'-(2-OXO-3H-1,2,3,5-OXATHIADIAZOL-4-YL)BIPHENYL) METHYL)-BENZIMIDAZOLE-7-CARBOXYLATE; USE TO TREAT CIRCULATORY DISEASES SUCH AS HYPERTENSIVE DISEASES AND HEART DISEASES TAKEDA CHEMICAL INDUSTRIES, LTD. (JP) 2000-08-08 US disclosed
US-5639773-A TREATING GLAUCOMA SENJU PHARMACEUTICAL CO., LTD. (JP) 1997-06-17 US disclosed
US-5583141-A ADMINISTERING AS THERAPEUTIC AGENTS OF CIRCULATORY DISEASES; AZILSARTAN; ANGIOTENSIN II ANTAGONISTS TAKEDA CHEMICAL INDUSTRIES, LTD. (JP) 1996-12-10 US disclosed
WO-1995001176-A1 USE OF AN ANGIOTENSIN II ANTAGONIST AS AN OCULAR HYPOTENSIVE AGENT SENJU PHARMACEUTICAL CO., LTD. (JP) 1995-01-12 WO disclosed
EP-0631780-A1 Use of an angiotensin II antagonist as an ocular hypotensive agent TAKEDA CHEMICAL INDUSTRIES, LTD. (JP) 1995-01-04 EP disclosed
US-5354766-A 2-Ethoxy-1-((2'(2,5-dihydro-5-oxo-1,2,4-oxadiazol-3-yl) biphenyl-4-yl)methyl)benzimidazole-7-carboxylic acid; hypotensive agents; CNS activity TAKEDA CHEMICAL INDUSTRIES, LTD. (JP) 1994-10-11 US disclosed
US-5243054-A Hypotensive agents, cardiovascular disorders or nervous system disorders TAKEDA CHEMICAL INDUSTRIES, LTD. (JP) 1993-09-07 US disclosed
EP-0520423-A2 Heterocyclic compounds, their production and use as angiotensin II antagonists TAKEDA CHEMICAL INDUSTRIES, LTD. (JP) 1992-12-30 EP disclosed