SCHEMBL23739192

SCHEMBL23739192

CC(=O)NCCCCCC(=O)NOCc1ccc(NC(=O)[C@H](CCCNC(N)=O)NC(=O)CNC(=O)CCCC(=O)C(C)C)cc1

nearest known ligand 0.38

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
SIRT2 Q8IXJ6 10/20 0.38
SIRT1 Q96EB6 9/20 0.38
NPY5R Q15761 5/20 0.38
NPY4R P50391 5/20 0.38
NPY1R P25929 4/20 0.38
NPY2R P49146 2/20 0.38
SIRT3 Q9NTG7 5/20 0.36
SIRT5 Q9NXA8 2/20 0.36
ALB P02768 1/20 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
SCHEMBL23739148 0.93 SIRT2 (0.43) SIRT2SIRT1NPY5RNPY4RNPY1R
SCHEMBL20880254 0.93 SIRT2 (0.39) SIRT2SIRT1NPY5RNPY4RNPY1R
SCHEMBL24253175 0.87 SIRT2 (0.41) SIRT2SIRT1NPY5RNPY4RNPY1R
SCHEMBL20880212 0.87 SIRT2 (0.44) SIRT2SIRT1SIRT3
SCHEMBL24115692 0.87 SIRT2 (0.37) SIRT2SIRT1NPY5RNPY4RNPY1R
SCHEMBL19841675 0.84 NPY5R (0.39) SIRT2SIRT1NPY5RNPY4RNPY1R
SCHEMBL16646739 0.83 NPY5R (0.39) SIRT2SIRT1NPY5RNPY4RNPY1R
SCHEMBL19522514 0.83 NPY4R (0.42) SIRT2SIRT1NPY5RNPY4RNPY1R
SCHEMBL20015437 0.82 NPY5R (0.40) SIRT2SIRT1NPY5RNPY4RNPY1R
SCHEMBL25765429 0.78 NPY5R (0.40) SIRT2SIRT1NPY5RNPY4RNPY1R

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
EP-3590541-B1 DRUG-CONJUGATES AND USES THEREOF CONCORTIS BIOSYSTEMS CORP (US) 2021-08-11 EP disclosed