SCHEMBL4654976

SCHEMBL4654976

O=C(O)CCCCCCOc1ccc(F)cc1

nearest known ligand 0.61

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PPARA Q07869 4/20 0.61
LTA4H P09960 2/20 0.58
KDM4E B2RXH2 1/20 0.58
SMN1; SMN2 Q16637 1/20 0.58
ALB P02768 1/20 0.57
PLA2G4B P0C869 1/20 0.55
HDAC1 Q13547 2/20 0.53
HDAC2 Q92769 2/20 0.53
PPARG P37231 1/20 0.52
L3MBTL1 Q9Y468 1/20 0.51
FFAR1 O14842 1/20 0.51
HDAC3 O15379 1/20 0.51
HDAC4 P56524 1/20 0.51
HDAC7 Q8WUI4 1/20 0.51
HDAC10 Q969S8 1/20 0.51
HDAC11 Q96DB2 1/20 0.51
HDAC8 Q9BY41 1/20 0.51
HDAC6 Q9UBN7 1/20 0.51
HDAC9 Q9UKV0 1/20 0.51
HDAC5 Q9UQL6 1/20 0.51

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
SCHEMBL1008370 1.00 PPARA (0.61) PPARALTA4HKDM4ESMN1; SMN2ALB
SCHEMBL8863703 1.00 PPARA (0.61) PPARALTA4HKDM4ESMN1; SMN2ALB
SCHEMBL4654038 1.00 PPARA (0.61) PPARALTA4HKDM4ESMN1; SMN2ALB
SCHEMBL4401690 0.98 PPARA (0.63) PPARALTA4HKDM4ESMN1; SMN2ALB
SCHEMBL3256041 0.93 LTA4H (0.61) PPARALTA4HKDM4ESMN1; SMN2PPARG
SCHEMBL29141429 0.91 PPARA (0.71) PPARAALBPLA2G4BHDAC1HDAC2
SCHEMBL21073528 0.91 PPARA (0.71) PPARAALBPLA2G4BHDAC1HDAC2
SCHEMBL31448424 0.91 PPARA (0.71) PPARAALBPLA2G4BHDAC1HDAC2
SCHEMBL31448470 0.89 PPARA (0.73) PPARAALBPLA2G4BHDAC1HDAC2
SCHEMBL652824 0.87 L3MBTL1 (0.67) PPARALTA4HKDM4ESMN1; SMN2PPARG

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1113033-B1 Polyhydroxyalkanoate CANON KK (JP) 2008-11-26 EP disclosed
US-7169598-B2 Polyhydroxyalkanoate, method for production thereof and microorganisms for use in the same CANON KABUSHIKI KAISHA (JP) 2007-01-30 US disclosed
US-20040067576-A1 Polyhydroxyalkanoate, method for production thereof and microorganisms for use in the same CANON KABUSHIKI KAISHA (JP) 2004-04-08 US disclosed
US-6649381-B1 Biosynthesis of high purity polylactones CANON KABUSHIKI KAISHA (JP) 2003-11-18 US disclosed
US-20030208029-A1 Polyhydroxyalkanoate, method for production thereof and microorganisms for use in the same CANON KABUSHIKI KAISHA (JP) 2003-11-06 US disclosed
US-6586562-B2 Polylactone with units such as of 3-hydroxy-5-(4-fluorophenyl)valeric acid; biosynthesis of the polylactone by microorganism; Pseudomonas cichorii; P. putida; P. jessenii CANON KABUSHIKI KAISHA (JP) 2003-07-01 US disclosed
US-20020022253-A1 Polyhydroxyalkanoate, method for production thereof and microorganisms for use in the same CANON KABUSHIKI KAISHA (JP) 2002-02-21 US disclosed
EP-1113033-A2 Polyhydroxyalkanoate, method for production thereof and microorganisms for use in the same CANON KABUSHIKI KAISHA (JP) 2001-07-04 EP disclosed