SCHEMBL7611682

SCHEMBL7611682

CCCCC/C=C\C=CCOC(C)=O

nearest known ligand 0.53

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
FASN P49327 1/20 0.53
ALDH1A1 P00352 2/20 0.50
TSHR P16473 1/20 0.50
PTPN1 P18031 1/20 0.49
FAAH O00519 5/20 0.45
KDM4E B2RXH2 1/20 0.45
PRKCA P17252 1/20 0.44

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
SCHEMBL21112081 1.00 FASN (0.53) FASNALDH1A1TSHRPTPN1FAAH
SCHEMBL21112082 1.00 FASN (0.53) FASNALDH1A1TSHRPTPN1FAAH
SCHEMBL7197131 0.98 FASN (0.56) FASNALDH1A1TSHRPTPN1FAAH
SCHEMBL31402500 0.94 ALDH1A1 (0.47) FASNALDH1A1TSHRPTPN1FAAH
SCHEMBL1302239 0.89 FAAH (0.50) PTPN1FAAHPRKCA
SCHEMBL29080381 0.89 FAAH (0.50) PTPN1FAAHPRKCA
SCHEMBL1302237 0.89 FAAH (0.50) PTPN1FAAHPRKCA
SCHEMBL1301613 0.87 FAAH (0.53) PTPN1FAAHPRKCA
SCHEMBL1302485 0.87 FAAH (0.53) PTPN1FAAHPRKCA
SCHEMBL1302086 0.87 FAAH (0.53) PTPN1FAAHPRKCA

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-6451366-B1 ADDING A PURE (-)-TRANS4,5-EPOXY-(E)-2-DECENAL TO ENHANCE FLAVOR OF FOODS GIVAUDAN SA (CH) 2002-09-17 US disclosed
US-20020081370-A1 Epoxydecenal isomers GIVAUDAN SA 2002-06-27 US disclosed
US-6335047-B1 Epoxydecenal isomers GIVAUDAN SA (CH) 2002-01-01 US disclosed