SCHEMBL25912166

SCHEMBL25912166

CCCCCCCCCCCCCC(=O)NCCC[N+](C)(C)CC(=O)OO

nearest known ligand 0.51

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
FAAH O00519 4/20 0.51
DNM1 Q05193 2/20 0.49
CASP2 P42575 1/20 0.49
NAAA Q02083 1/20 0.46
L3MBTL1 Q9Y468 1/20 0.45
EPHX2 P34913 3/20 0.45
SLC6A5 Q9Y345 2/20 0.44
KDM4E B2RXH2 1/20 0.42

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
SCHEMBL17244840 0.90 FAAH (0.53) FAAHDNM1CASP2NAAAL3MBTL1
SCHEMBL27482156 0.90 FAAH (0.53) FAAHDNM1CASP2NAAAL3MBTL1
SCHEMBL21101114 0.86 CASP2 (0.53) FAAHDNM1CASP2NAAAL3MBTL1
Hydrochloric Acid SCHEMBL10869887 0.85 NPSR1 (0.55) FAAHDNM1CASP2L3MBTL1KDM4E
Hydrochloric Acid SCHEMBL2121667 0.85 NPSR1 (0.55) FAAHDNM1CASP2L3MBTL1KDM4E
SCHEMBL5466090 0.84 FAAH (0.55) FAAHDNM1CASP2NAAAEPHX2
SCHEMBL103617 0.84 FAAH (0.55) FAAHDNM1CASP2NAAAEPHX2
SCHEMBL16604272 0.84 FAAH (0.55) FAAHDNM1CASP2NAAAEPHX2
SCHEMBL4572673 0.84 FAAH (0.55) FAAHDNM1CASP2NAAAEPHX2
SCHEMBL6751347 0.84 FAAH (0.55) FAAHDNM1CASP2NAAAEPHX2

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
US-20230244134-A1 Photographic Paper FUJIFILM MANUFACTURING EUROPE B.V. (NL) 2023-08-03 US disclosed