SCHEMBL27482156

SCHEMBL27482156

CCCCCCCCCCCC(=O)NCCC[N+](C)(C)CC(=O)OC

nearest known ligand 0.53

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
FAAH O00519 4/20 0.53
DNM1 Q05193 2/20 0.50
CASP2 P42575 1/20 0.50
NAAA Q02083 1/20 0.47
L3MBTL1 Q9Y468 1/20 0.46
EPHX2 P34913 3/20 0.46
ALDH1A1 P00352 1/20 0.45
SLC6A5 Q9Y345 1/20 0.45
POLB P06746 1/20 0.44
POLA1 P09884 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
SCHEMBL17244840 1.00 FAAH (0.53) FAAHDNM1CASP2NAAAL3MBTL1
SCHEMBL21101114 0.96 CASP2 (0.53) FAAHDNM1CASP2NAAAL3MBTL1
SCHEMBL19655478 0.92 EPHX2 (0.59) EPHX2ALDH1A1SLC6A5
SCHEMBL25912166 0.90 FAAH (0.51) FAAHDNM1CASP2NAAAL3MBTL1
SCHEMBL17244843 0.87 FAAH (0.41) FAAHDNM1CASP2NAAAL3MBTL1
SCHEMBL20662655 0.87 EPHX2 (0.52) EPHX2ALDH1A1SLC6A5
Hydrochloric Acid SCHEMBL2121667 0.87 NPSR1 (0.55) FAAHDNM1CASP2L3MBTL1
Hydrochloric Acid SCHEMBL10869887 0.87 NPSR1 (0.55) FAAHDNM1CASP2L3MBTL1
SCHEMBL20662591 0.86 EPHX2 (0.50) EPHX2ALDH1A1SLC6A5
SCHEMBL12939017 0.85 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
WO-2023196956-A9 FOAM STABILIZATION USING NANOPARTICLES SAUDI ARABIAN OIL COMPANY (SA) 2024-07-04 WO disclosed