SCHEMBL16797495

SCHEMBL16797495

O=C(O)C=CC=CC(O)CCCCCC=CCCCCCCCO

nearest known ligand 0.64

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
ACHE P22303 1/20 0.58
BACE1 P56817 1/20 0.58
PPARG P37231 2/20 0.52
GPR132 Q9UNW8 1/20 0.52
FAAH O00519 1/20 0.48
LTB4R2 Q9NPC1 2/20 0.47
ALOX5 P09917 2/20 0.47
MAPT P10636 1/20 0.47
ALDH1A1 P00352 1/20 0.47
LTB4R Q15722 1/20 0.47

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
SCHEMBL21049245 0.92 ACHE (0.67) ACHEBACE1PPARGGPR132FAAH
SCHEMBL29256074 0.92 ACHE (0.67) ACHEBACE1PPARGGPR132FAAH
SCHEMBL23647621 0.92 ACHE (0.67) ACHEBACE1PPARGGPR132FAAH
SCHEMBL27776648 0.91 ACHE (0.58) ACHEBACE1PPARGGPR132FAAH
SCHEMBL667165 0.91 ACHE (0.65) ACHEBACE1PPARGGPR132FAAH
SCHEMBL30072208 0.91 ACHE (0.65) ACHEBACE1PPARGGPR132FAAH
SCHEMBL6129416 0.91 ACHE (0.65) ACHEBACE1PPARGGPR132FAAH
SCHEMBL15287182 0.80 ACHE (0.49) ACHEBACE1PPARGGPR132FAAH
SCHEMBL561406 0.80 ACHE (0.49) ACHEBACE1PPARGGPR132FAAH
SCHEMBL4759937 0.80 ACHE (0.49) ACHEBACE1PPARGGPR132FAAH

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
WO-2023146984-A1 LYMPH-RELEASING COMPOSITIONS OF FATTY ACIDS AND USES THEREOF FOR LYMPHATIC INCORPORATION AND SYSTEMIC DISEASE TREATMENT AMARIN PHARMACEUTICALS IRELAND LIMITED (IE) 2023-08-03 WO claimed
EP-4329742-A1 COMPOSITIONS COMPRISING EPA AND METHODS OF USING THE SAME FOR TREATING AND/OR PREVENTING ENDOTHELIAL DYSFUNCTION IN A SUBJECT Amarin Pharmaceuticals Ireland Limited (IE) 2024-03-06 EP disclosed
WO-2023146984-A1 LYMPH-RELEASING COMPOSITIONS OF FATTY ACIDS AND USES THEREOF FOR LYMPHATIC INCORPORATION AND SYSTEMIC DISEASE TREATMENT AMARIN PHARMACEUTICALS IRELAND LIMITED (IE) 2023-08-03 WO disclosed
WO-2018148342-A1 COMPRESSED OPEN FLOW ASSAY AND USE ESSENLIX CORPORATION (US) 2018-08-16 WO disclosed
EP-3080613-A1 DIFFERENTIAL DIAGNOSIS OF LIVER DISEASE The Regents of the University of California (US) 2016-10-19 EP disclosed
WO-2015089102-A1 DIFFERENTIAL DIAGNOSIS OF LIVER DISEASE THE REGENTS OF THE UNIVERSITY OF CALIFORNIA (US) 2015-06-18 WO disclosed
CN-104335049-A P-cresol sulphate as biomarker for healthy aging NESTEC SA 2015-02-04 CN disclosed
CN-104321651-A Hydroxy-sphingomyelin 22:1 as biomarker for healthy ageing NESTEC SA 2015-01-28 CN disclosed
CN-104285150-A 1-o-alkyl-2-acylglycerophosphocholine (pc-o) 40:1 as biomarker for healthy ageing NESTEC SA 2015-01-14 CN disclosed
CN-104204810-A Phenylacetylglutamine as biomarker for healthy ageing NESTEC SA 2014-12-10 CN disclosed
CN-104204809-A 9-oxo-octadecadienoic acid (9-oxo-HODE) as biomarker for healthy aging NESTEC SA 2014-12-10 CN disclosed
CN-101663031-A Oxylipins from long chain polyunsaturated fatty acids and methods of making and using the same MARTEK BIOSCIENCES CORP 2010-03-03 CN disclosed