SCHEMBL2472298

SCHEMBL2472298

CNC(=O)C(Cc1cn(C(c2ccccc2)(c2ccccc2)c2ccccc2)cn1)NC(=O)CN(CC#N)Cc1ccccc1

nearest known ligand 0.49

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
SIRT2 Q8IXJ6 13/20 0.49
NMBR P28336 1/20 0.38
PIN1 Q13526 2/20 0.38
CTSL P07711 4/20 0.37
CTSB P07858 1/20 0.37
CTSS P25774 1/20 0.37
CTSK P43235 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
SCHEMBL2472296 1.00 SIRT2 (0.49) SIRT2NMBRPIN1CTSLCTSB
SCHEMBL2478687 0.91 SIRT2 (0.51) SIRT2NMBRPIN1
SCHEMBL2469578 0.83 SIRT2 (0.45) SIRT2NMBR
SCHEMBL2469579 0.83 SIRT2 (0.45) SIRT2NMBR
SCHEMBL2476426 0.82 SIRT2 (0.61) SIRT2NMBR
SCHEMBL2477239 0.82 SIRT2 (0.61) SIRT2NMBR
SCHEMBL2476422 0.82 SIRT2 (0.61) SIRT2NMBR
SCHEMBL2472940 0.82 SIRT2 (0.49) SIRT2NMBR
SCHEMBL2474784 0.80 SIRT2 (0.50) SIRT2NMBRCTSB
SCHEMBL2472392 0.80 SIRT2 (0.51) SIRT2NMBR

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
EP-2371421-A1 Ligands of insulin degrading enzyme and their uses Université de Lille 2 Droit et Santé (FR) 2011-10-05 EP disclosed
WO-2011107948-A2 LIGANDS OF INSULIN DEGRADING ENZYME AND THEIR USES UNIVERSITE LILLE 2 DROIT ET SANTE (FR) 2011-09-09 WO disclosed