SCHEMBL5670146

SCHEMBL5670146

CCCCCCc1ccc(CCCCCCC(C)=O)o1

nearest known ligand 0.64

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
EPHX2 P34913 1/20 0.64
ELANE P08246 3/20 0.48
PPARA Q07869 1/20 0.46
FAAH O00519 1/20 0.44
ALOX5 P09917 2/20 0.43
PTGS1 P23219 1/20 0.43
PTGS2 P35354 1/20 0.43
SCD O00767 1/20 0.42
HSD17B3 P37058 5/20 0.41
MAPT P10636 1/20 0.41
CES2 O00748 1/20 0.41
CES1 P23141 1/20 0.41

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
SCHEMBL29236924 0.86 EPHX2 (0.83) EPHX2PPARASCDMAPT
SCHEMBL8087417 0.86 EPHX2 (0.83) EPHX2PPARASCDMAPT
SCHEMBL3506260 0.86 EPHX2 (0.83) EPHX2PPARASCDMAPT
SCHEMBL2703694 0.86 EPHX2 (0.83) EPHX2PPARASCDMAPT
SCHEMBL14054041 0.86 EPHX2 (0.83) EPHX2PPARASCDMAPT
SCHEMBL31240243 0.85 EPHX2 (0.81) EPHX2PPARASCDMAPT
SCHEMBL29236858 0.85 EPHX2 (0.81) EPHX2PPARASCDMAPT
SCHEMBL2475925 0.83 EPHX2 (0.65) EPHX2ELANEPPARAFAAHSCD
SCHEMBL10878735 0.83 EPHX2 (0.57) EPHX2ELANEALOX5PTGS1PTGS2
SCHEMBL30889345 0.83 EPHX2 (0.57) EPHX2ELANEALOX5PTGS1PTGS2

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-1720988-A2 METHOD FOR PRODUCING UNSATURATED &ohgr;3 FATTY ACIDS IN TRANSGENIC ORGANISMS BASF Plant Science GmbH (DE) 2006-11-15 EP disclosed
WO-2005083053-A2 METHOD FOR PRODUCING UNSATURATED OMEGA-3 FATTY ACIDS IN TRANSGENIC ORGANISMS BASF PLANT SCIENCE GMBH (DE) 2005-09-09 WO disclosed