SCHEMBL7947017

SCHEMBL7947017

CCCCCC=C(CCC)OC(C)=O

nearest known ligand 0.44

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
EP300 Q09472 1/20 0.44
FAAH O00519 3/20 0.40
PPARG P37231 5/20 0.39
PPARA Q07869 4/20 0.39
TERT O14746 3/20 0.39
PTPN1 P18031 3/20 0.39
PPARD Q03181 3/20 0.39
TOP1 P11387 3/20 0.39
CYP1A2 P05177 2/20 0.39
MAPT P10636 2/20 0.39
CYP2C19 P33261 2/20 0.39
BLM P54132 2/20 0.39
HSD17B10 Q99714 2/20 0.39
FABP4 P15090 2/20 0.39
KMT2A Q03164 2/20 0.39
GMNN O75496 1/20 0.39
USP2 O75604 1/20 0.39
LMNA P02545 1/20 0.39
POLB P06746 1/20 0.39
CYP2C9 P11712 1/20 0.39

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
SCHEMBL6537010 0.91 EP300 (0.47) EP300FAAHPPARGPPARATERT
SCHEMBL6692822 0.91 EP300 (0.47) EP300FAAHPPARGPPARATERT
SCHEMBL28682791 0.91 EP300 (0.47) EP300FAAHPPARGPPARATERT
SCHEMBL11293823 0.87 CES1 (0.39) EP300FAAHPPARGPPARATERT
SCHEMBL5369516 0.85 PPARG (0.42) EP300FAAHPPARGPPARATERT
SCHEMBL9679914 0.85 FAAH (0.49) FAAHPPARGPPARATERTPTPN1
SCHEMBL5369513 0.85 PPARG (0.42) EP300FAAHPPARGPPARATERT
SCHEMBL5010173 0.84 TSHR (0.48) EP300FAAHPPARGPPARATERT
SCHEMBL4015036 0.84 TSHR (0.48) EP300FAAHPPARGPPARATERT
SCHEMBL808517 0.84 FAAH (0.42) FAAHPPARGPPARATERTPTPN1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2001013741-A1 CIS-DEC-4-ENYL ACETATE AS A FLAVORING AGENT AND METHODS FOR PREPARING AND USING SAME BUSH BOAKE ALLEN INC. (US) 2001-03-01 WO disclosed