SCHEMBL29630767

SCHEMBL29630767

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

nearest known ligand 0.39

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
NPY4R P50391 12/20 0.39
NPY5R Q15761 9/20 0.39
NPY1R P25929 8/20 0.39
NPY2R P49146 6/20 0.39
GNPAT O15228 1/20 0.38
PTGS1 P23219 1/20 0.37
GSTK1 Q9Y2Q3 1/20 0.37
SIRT5 Q9NXA8 1/20 0.36
QRFPR Q96P65 1/20 0.36
ITGB3 P05106 1/20 0.36
ITGA2B P08514 1/20 0.36
GLO1 Q04760 1/20 0.35

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
SCHEMBL21961850 0.95 ITGB3 (0.40) NPY4RNPY5RNPY1RNPY2RPTGS1
SCHEMBL19426417 0.95 ITGB3 (0.40) NPY4RNPY5RNPY1RNPY2RPTGS1
SCHEMBL19426331 0.95 ITGB3 (0.40) NPY4RNPY5RNPY1RNPY2RPTGS1
SCHEMBL30372208 0.95 NPY4R (0.42) NPY4RNPY5RNPY1RNPY2RPTGS1
SCHEMBL31691754 0.95 NPY4R (0.42) NPY4RNPY5RNPY1RNPY2RPTGS1
SCHEMBL29354257 0.93 PTGS1 (0.41) NPY4RNPY5RNPY1RNPY2RPTGS1
SCHEMBL30373025 0.92 QRFPR (0.41) NPY4RNPY5RNPY1RNPY2RPTGS1
SCHEMBL30372279 0.92 QRFPR (0.41) NPY4RNPY5RNPY1RNPY2RPTGS1
SCHEMBL29630595 0.91 NMT1 (0.44) NPY4RNPY5RNPY1RNPY2RPTGS1
SCHEMBL31064851 0.91 GNPAT (0.44) NPY4RNPY5RNPY1RNPY2RGNPAT

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
US-11807899-B2 Biochemical reaction methods and reagents comprising intrinsically disordered regions Biocrucible Limited 2023-11-07 US disclosed
US-20220145378-A1 BIOCHEMICAL REACTION METHODS AND REAGENTS COMPRISING INTRINSICALLY DISORDERED REGIONS Biocrucible Limited (GB) 2022-05-12 US disclosed