SCHEMBL1271045

SCHEMBL1271045

O=C(O)CCCOc1ccc(O)cc1

nearest known ligand 0.70

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
ESR1 P03372 2/20 0.59
ALB P02768 1/20 0.58
PPARA Q07869 3/20 0.57
L3MBTL1 Q9Y468 1/20 0.56
CYSLTR2 Q9NS75 1/20 0.54
CYSLTR1 Q9Y271 1/20 0.54
LTA4H P09960 1/20 0.53
NR5A1 Q13285 1/20 0.53
FFAR1 O14842 2/20 0.53
FFAR4 Q5NUL3 2/20 0.53

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
SCHEMBL2158826 0.92 ALB (0.68) ESR1ALBPPARANR5A1
SCHEMBL7747968 0.92 ALB (0.68) ESR1ALBPPARANR5A1
SCHEMBL12534514 0.92 ALB (0.68) ESR1ALBPPARANR5A1
SCHEMBL31448501 0.92 PPARA (0.65) ALBPPARAL3MBTL1CYSLTR2CYSLTR1
Mequinol SCHEMBL10533614 0.91 PDE4B (0.57) ESR1ALBPPARAL3MBTL1FFAR1
SCHEMBL2494017 0.91 ALB (0.66) ESR1ALBPPARANR5A1
SCHEMBL2468006 0.90 L3MBTL1 (0.69) ESR1ALBPPARAL3MBTL1LTA4H
SCHEMBL31448470 0.85 PPARA (0.73) ALBPPARAL3MBTL1FFAR1
SCHEMBL10948921 0.84 ESR1 (0.61) ESR1ALBPPARAL3MBTL1LTA4H
SCHEMBL29089242 0.84 PLA2G4B (0.68) PPARAL3MBTL1

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-9080015-B2 Biocompatible polymers for medical devices RUTGERS, THE STATE UNIVERSITY OF NEW JERSEY (US) 2015-07-14 US disclosed
US-20120178885-A1 BIOCOMPATIBLE POLYMERS FOR MEDICAL DEVICES RUTGERS, THE STATE UNIVERSITY OF NEW JERSEY (US) 2012-07-12 US disclosed
EP-2459637-A1 BIOCOMPATIBLE POLYMERS FOR MEDICAL DEVICES Rutgers, The State University of New Jersey (US) 2012-06-06 EP disclosed
WO-2011014859-A1 BIOCOMPATIBLE POLYMERS FOR MEDICAL DEVICES RUTGERS, THE STATE UNIVERSITY OF NEW JERSEY (US) 2011-02-03 WO disclosed
EP-1403948-B1 Electrolyte compositions DAINICHISEIKA COLOR CHEM (JP) 2010-07-28 EP disclosed
US-20100036060-A1 ELECTROLYTE COMPOSITIONS DAINICHISEIKA COLOR & CHEMICALS MFG. CO., LTD. (JP) 2010-02-11 US disclosed
EP-1403948-A2 Electrolyte compositions DAINICHISEIKA COLOR & CHEMICALS MFG. CO. LTD. (JP) 2004-03-31 EP disclosed
US-20040023121-A1 Ion-conducting polymer and oligomer, formed by reacting a polymer or monomer having epoxy groups with CO2 to form cyclic carbonate groups DAINICHISEIKA COLOR & CHEMICALS MFG. CO., LTD. (JP) 2004-02-05 US disclosed
US-5871709-A TETRAAZACYCLODODECANE COMPOUNDS SUBSTITUTED WITH ALKYL CARBOXY COMPOUNDS FOR CARDIOVASCULAR DISORDERS AND BRAIN TUMORS SCHERING AKTIENGESELLSCHAFT (DE) 1999-02-16 US disclosed
US-5516767-A PRODRUG AS HYPOGLYCEMIC AGENT SANDOZ LTD. (CH) 1996-05-14 US disclosed
US-5412137-A Hypoglycemic agents SANDOZ LTD. (CH) 1995-05-02 US disclosed
US-5277895-A Nuclear magnetic resonance SCHERING AKTIENGESELLSCHAFT (DE) 1994-01-11 US disclosed