SCHEMBL29555348

SCHEMBL29555348

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

nearest known ligand 0.42

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
NPY4R P50391 15/20 0.42
NPY1R P25929 9/20 0.42
NPY5R Q15761 7/20 0.42
NPY2R P49146 5/20 0.42
PTGS1 P23219 1/20 0.40
GSTK1 Q9Y2Q3 1/20 0.40
GLO1 Q04760 1/20 0.38
SIRT5 Q9NXA8 1/20 0.34
EGFR P00533 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
SCHEMBL29630523 0.95 NPY4R (0.40) NPY4RNPY1RNPY5RNPY2RPTGS1
SCHEMBL30676230 0.94 NPY4R (0.41) NPY4RNPY1RNPY5RNPY2RPTGS1
SCHEMBL3505407 0.92 NPY4R (0.48) NPY4RNPY1RNPY5RNPY2RPTGS1
SCHEMBL30193470 0.91 NPY4R (0.47) NPY4RNPY1RNPY5RNPY2RPTGS1
SCHEMBL29630413 0.91 PTGS1 (0.43) NPY4RNPY1RNPY5RNPY2RPTGS1
SCHEMBL14027228 0.91 NPY4R (0.40) NPY4RNPY1RNPY5RNPY2RPTGS1
SCHEMBL30929978 0.91 NPY4R (0.50) NPY4RNPY1RNPY5RNPY2RPTGS1
SCHEMBL29412493 0.91 NPY4R (0.50) NPY4RNPY1RNPY5RNPY2RPTGS1
SCHEMBL30148051 0.91 NPY4R (0.50) NPY4RNPY1RNPY5RNPY2RPTGS1
SCHEMBL30544344 0.89 NPY4R (0.42) NPY4RNPY1RNPY5RNPY2RPTGS1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-109789180-B KIF 13B-derived peptides and methods of inhibiting angiogenesis 伊利诺伊大学理事会 2023-09-08 CN disclosed
US-11299524-B2 KIF13B-derived peptide and method of inhibiting angiogenesis THE BOARD OF TRUSTEES OF THE UNIVERSITY OF ILLINOIS (US) 2022-04-12 US disclosed