SCHEMBL5057281

SCHEMBL5057281

CCC=C(C(=O)OCC)C(N)CCCCC

nearest known ligand 0.41

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
DPP7 Q9UHL4 4/20 0.41
GNAI3 P08754 1/20 0.40
GNAO1 P09471 1/20 0.40
GNAI1 P63096 1/20 0.40
FAAH O00519 2/20 0.39
TP53 P04637 1/20 0.39
GRIK1 P39086 2/20 0.38
GRIK2 Q13002 2/20 0.38
SLC1A2 P43004 1/20 0.38
SLC1A1 P43005 1/20 0.38
SLC15A1 P46059 1/20 0.38
OPRM1 P35372 1/20 0.37
NOD1 Q9Y239 3/20 0.36
ZDHHC7 Q9NXF8 1/20 0.36
DPP8 Q6V1X1 2/20 0.36
DPP9 Q86TI2 2/20 0.36
RRM1 P23921 1/20 0.36
DPP4 P27487 1/20 0.36
LAP3 P28838 1/20 0.35
TLR2 O60603 1/20 0.34

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
SCHEMBL1032646 0.89 NPSR1 (0.35) DPP7FAAHGRIK1GRIK2SLC1A2
SCHEMBL1034126 0.82 NPSR1 (0.37) GRIK1GRIK2
SCHEMBL301461 0.76 NPSR1 (0.38) GRIK1GRIK2
SCHEMBL11296849 0.76 NOD1 (0.52) DPP7GNAI3GNAO1GNAI1TP53
SCHEMBL17821260 0.74 NOD1 (0.55) DPP7GNAI3GNAO1GNAI1TP53
SCHEMBL11083554 0.74 NOD1 (0.55) DPP7GNAI3GNAO1GNAI1TP53
SCHEMBL27559165 0.74 LAP3 (0.41) DPP7GNAI3GNAO1GNAI1FAAH
SCHEMBL12200406 0.74 NPSR1 (0.42) FAAH
SCHEMBL13544930 0.73 CYP2D6 (0.36) FAAH
Hydrochloric Acid SCHEMBL8203130 0.73 NOD1 (0.53) DPP7GNAI3GNAO1GNAI1TP53

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-20080281014-A1 Nanosubstance-Containing Composition, Process for Producing the Same, and Composite Made With the Same MITSUBISHI RAYON CO., LTD. (JP) 2008-11-13 US disclosed