SCHEMBL7208007

SCHEMBL7208007

CCCC[C@H](N)C(=O)CC(C)(C)O[C]=O

nearest known ligand 0.41

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
METAP1 P53582 1/20 0.41
SLC1A2 P43004 2/20 0.39
SLC1A1 P43005 2/20 0.39
SLC1A3 P43003 1/20 0.39
DPP7 Q9UHL4 5/20 0.38
SLC15A1 P46059 1/20 0.38
CA2 P00918 4/20 0.36
CA1 P00915 3/20 0.36
DPP4 P27487 4/20 0.36
DPP8 Q6V1X1 4/20 0.36
DPP9 Q86TI2 4/20 0.36
GRIK1 P39086 2/20 0.35
GRIK2 Q13002 2/20 0.35
DDAH1 O94760 2/20 0.34
FAP Q12884 1/20 0.33
MAPK1 P28482 1/20 0.33
NOS1 P29475 1/20 0.32

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
SCHEMBL1518669 0.86 GSR (0.43) DPP7DPP4DPP8DPP9FAP
SCHEMBL10609769 0.81 GRM8 (0.43) SLC1A2SLC1A1SLC1A3DPP4DPP8
SCHEMBL10607358 0.80
SCHEMBL10608145 0.79 NPY4R (0.33) DPP7
SCHEMBL10609664 0.78 SLC7A5 (0.41) SLC1A2SLC1A3DPP4
SCHEMBL10608122 0.78 GRIK1 (0.30) GRIK1
SCHEMBL10611194 0.78 GRIK1 (0.33) GRIK1
SCHEMBL10609669 0.78 SLC7A5 (0.41) SLC1A2SLC1A3DPP4
SCHEMBL10608128 0.78 GRIK1 (0.30) GRIK1
SCHEMBL8937176 0.73 SLC7A5 (0.34) DPP4

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-20030036514-A1 Compositions and methods for the diagnosis and treatment of psychogenic erectile dysfunction MANN MORRIS (US) 2003-02-20 US disclosed