SCHEMBL16359366

SCHEMBL16359366

NCCCC[C@H](N)C(=O)N(O)[C@@H](CO)C(N)=O

nearest known ligand 0.46

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
GSR P00390 1/20 0.46
GNAI3 P08754 1/20 0.38
GNAO1 P09471 1/20 0.38
GNAI1 P63096 1/20 0.38
DPP7 Q9UHL4 9/20 0.37
DPP8 Q6V1X1 4/20 0.37
DPP9 Q86TI2 4/20 0.37
DPP4 P27487 3/20 0.37
RNPEP Q9H4A4 1/20 0.33
FAP Q12884 1/20 0.31

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
SCHEMBL17459295 0.80 GSR (0.58) GSRGNAI3GNAO1GNAI1RNPEP
SCHEMBL17459299 0.80 GSR (0.58) GSRGNAI3GNAO1GNAI1RNPEP
SCHEMBL29483946 0.72 GSR (0.67) GSRGNAI3GNAO1GNAI1DPP7
SCHEMBL363001 0.72 GSR (0.67) GSRGNAI3GNAO1GNAI1DPP7
SCHEMBL5498760 0.72 GSR (0.67) GSRGNAI3GNAO1GNAI1DPP7
SCHEMBL358119 0.72 GSR (0.67) GSRGNAI3GNAO1GNAI1DPP7
SCHEMBL3720346 0.72 GSR (0.47) GSRGNAI3GNAO1GNAI1RNPEP
SCHEMBL24722227 0.70 GSR (0.64) GSRGNAI3GNAO1GNAI1DPP7
Hydrochloric Acid SCHEMBL8497748 0.70 GSR (0.64) GSRGNAI3GNAO1GNAI1DPP7
SCHEMBL362251 0.70 GSR (0.64) GSRGNAI3GNAO1GNAI1DPP7

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-2010053548-A2 PTHR1 RECEPTOR COMPOUNDS ANCHOR THERAPEUTICS, INC. (US) 2010-05-14 WO disclosed