SCHEMBL4450329

SCHEMBL4450329

CCC(O)CCCCCCC(O)CCCC=CC=CC=CC(=O)O.CCCCCCCCC(O)CCCCC=C(O)C=CC=CC(=O)O

nearest known ligand 0.45

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
PPARG P37231 2/20 0.45
GPR132 Q9UNW8 1/20 0.45
FFAR1 O14842 1/20 0.43
FFAR4 Q5NUL3 1/20 0.43
PTPN1 P18031 1/20 0.43
KDM4E B2RXH2 1/20 0.42
FASN P49327 1/20 0.42
CNR1 P21554 1/20 0.41
CNR2 P34972 1/20 0.41
ALDH1A1 P00352 1/20 0.40
MAPT P10636 1/20 0.40
ACHE P22303 1/20 0.40
BACE1 P56817 1/20 0.40

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
SCHEMBL4450325 1.00 PPARG (0.45) PPARGGPR132FFAR1FFAR4PTPN1
SCHEMBL21645848 0.90 ACHE (0.48) PPARGGPR132FFAR1FFAR4PTPN1
SCHEMBL29706604 0.90 ACHE (0.48) PPARGGPR132FFAR1FFAR4PTPN1
SCHEMBL31203472 0.90 ACHE (0.48) PPARGGPR132FFAR1FFAR4PTPN1
SCHEMBL25331233 0.89 ACHE (0.49) PPARGGPR132FFAR1FFAR4PTPN1
SCHEMBL30468660 0.89 ACHE (0.42) PPARGFFAR1FFAR4PTPN1ALDH1A1
SCHEMBL2258346 0.89 ACHE (0.49) PPARGGPR132FFAR1FFAR4PTPN1
SCHEMBL1526896 0.89 PPARG (0.55) PPARGGPR132FFAR1FFAR4PTPN1
SCHEMBL25331431 0.88 ACHE (0.43) PPARGFFAR1FFAR4PTPN1ALDH1A1
SCHEMBL21903102 0.88 PPARG (0.56) PPARGGPR132FFAR1FFAR4PTPN1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2120920-A2 OXYLIPINS FROM LONG CHAIN POLYUNSATURATED FATTY ACIDS AND METHODS OF MAKING AND USING THE SAME Martek Biosciences Corporation (US) 2009-11-25 EP claimed
WO-2008103753-A2 OXYLIPINS FROM LONG CHAIN POLYUNSATURATED FATTY ACIDS AND METHODS OF MAKING AND USING THE SAME MARTEK BIOSCIENCES CORPORATION (US) 2008-08-28 WO claimed