SCHEMBL22926765

SCHEMBL22926765

CCCCC/C=C\CCCCCCCCCCC(=O)NCCC(=O)O

nearest known ligand 0.88

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
FAAH O00519 3/20 0.88
CNR1 P21554 3/20 0.88
CNR2 P34972 2/20 0.88
EPHX2 P34913 2/20 0.85
KDM4E B2RXH2 1/20 0.78
KMT2A Q03164 3/20 0.71
MAPT P10636 3/20 0.71
MEN1 O00255 2/20 0.71
SLC6A5 Q9Y345 1/20 0.71
TERT O14746 3/20 0.69
PTPN1 P18031 3/20 0.69
PPARG P37231 3/20 0.69
PPARD Q03181 3/20 0.69
PPARA Q07869 3/20 0.69
BLM P54132 2/20 0.69
HSD17B10 Q99714 2/20 0.69
FABP4 P15090 2/20 0.69
GMNN O75496 1/20 0.69
USP2 O75604 1/20 0.69
LMNA P02545 1/20 0.69

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
SCHEMBL15298846 1.00 FAAH (0.88) FAAHCNR1CNR2EPHX2KDM4E
SCHEMBL10613896 1.00 FAAH (0.88) FAAHCNR1CNR2EPHX2KDM4E
SCHEMBL3994209 1.00 FAAH (0.88) FAAHCNR1CNR2EPHX2KDM4E
Hydrochloric Acid SCHEMBL9437240 0.98 FAAH (0.86) FAAHCNR1CNR2EPHX2KDM4E
SCHEMBL9437245 0.98 CNR1 (0.86) FAAHCNR1CNR2EPHX2KDM4E
SCHEMBL15296909 0.95 KDM4E (0.86) FAAHCNR1CNR2EPHX2KDM4E
SCHEMBL22457471 0.94 FAAH (1.00) FAAHCNR1CNR2EPHX2KDM4E
SCHEMBL22457463 0.94 FAAH (1.00) FAAHCNR1CNR2EPHX2KDM4E
SCHEMBL4384386 0.94 EPHX2 (0.85) FAAHCNR1CNR2EPHX2KDM4E
SCHEMBL4384381 0.94 EPHX2 (0.85) FAAHCNR1CNR2EPHX2KDM4E

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
US-11559071-B2 N-acyl-amino acid derivatives for improvement of the flavour profile of edible compositions GIVAUDAN SA (CH) 2023-01-24 US disclosed
US-20210022376-A1 N-ACYL-AMINO ACID DERIVATIVES FOR IMPROVEMENT OF THE FLAVOUR PROFILE OF EDIBLE COMPOSITIONS GIVAUDAN SA (CH) 2021-01-28 US disclosed