SCHEMBL5578552

SCHEMBL5578552

N=C(N)NCCC[C@@H]([C]=O)NC(=O)[C@@H](N)CCCCN

nearest known ligand 0.46

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
GNAI3 P08754 1/20 0.46
GNAO1 P09471 1/20 0.46
GNAI1 P63096 1/20 0.46
DPP7 Q9UHL4 4/20 0.40
DPP8 Q6V1X1 2/20 0.40
DPP9 Q86TI2 2/20 0.40
NPY4R P50391 9/20 0.40
NPY1R P25929 5/20 0.40
NPY2R P49146 4/20 0.40
NPY5R Q15761 4/20 0.40
GSR P00390 1/20 0.37
NOS1 P29475 1/20 0.36
RRM1 P23921 1/20 0.36
DPP4 P27487 1/20 0.36
MMP2 P08253 1/20 0.36
TERT O14746 2/20 0.36

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
SCHEMBL8697740 1.00 GNAI3 (0.46) GNAI3GNAO1GNAI1DPP7DPP8
SCHEMBL4586183 1.00 GNAI3 (0.46) GNAI3GNAO1GNAI1DPP7DPP8
SCHEMBL4586178 1.00 GNAI3 (0.46) GNAI3GNAO1GNAI1DPP7DPP8
SCHEMBL2183420 0.93 NPY4R (0.41) GNAI3GNAO1GNAI1DPP7DPP8
SCHEMBL1521188 0.93 NPY4R (0.41) GNAI3GNAO1GNAI1DPP7DPP8
SCHEMBL1521191 0.93 NPY4R (0.41) GNAI3GNAO1GNAI1DPP7DPP8
SCHEMBL15263460 0.88 NPY4R (0.48) GNAI3GNAO1GNAI1NPY4RNPY1R
SCHEMBL3043193 0.88 NPY4R (0.43) GNAI3GNAO1GNAI1NPY4RNPY1R
SCHEMBL2185394 0.87 NPY4R (0.58) GNAI3GNAO1GNAI1NPY4RNPY1R
SCHEMBL2195938 0.87 NPY4R (0.49) GNAI3GNAO1GNAI1DPP7NPY4R

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 7 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-5811401-A Advanced glycosylation endproducts and methods of use therefor THE PICOWER INSTITUTE FOR MEDICAL RESEARCH (US) 1998-09-22 US claimed
US-4861755-A Peptides with vasorelaxant, natriuretic and diuretic effects a process for their preparation, agents containing them, and their use HOECHST AKTIENGESELLSCHAFT (DE) 1989-08-29 US claimed
US-20150307912-A1 Site-Specific Incorporation of Phosphoserine Into Proteins in Escherichia Coli NATIONAL INSTITUTES OF HEALTH (NIH), U.S. DEPT. OF HEALTH AND HUMAN SERVICES (DHHS), U.S. GOVERNMENT 2015-10-29 US disclosed
US-20070248589-A1 Spatial for Altering Cell Proliferation VIVINT LLC 2007-10-25 US disclosed
EP-0314576-B1 TETRA AND PENTAPEPTIDES WITH THE SEQUENCE LYSYL-ARGINYL-ASPARTYL, AND THEIR USE AS ANTITHROMBOTICS INSTITUT DES VAISSEAUX ET DU SANG (FR) 1991-05-02 EP disclosed
US-4861755-A Peptides with vasorelaxant, natriuretic and diuretic effects a process for their preparation, agents containing them, and their use HOECHST AKTIENGESELLSCHAFT (DE) 1989-08-29 US disclosed
EP-0314576-A1 Tetra and pentapeptides with the sequence lysyl-arginyl-aspartyl, and their use as antithrombotics INSTITUT DES VAISSEAUX ET DU SANG (FR) 1989-05-03 EP disclosed