SCHEMBL2474784

SCHEMBL2474784

NC(=O)[C@@H](Cc1cn(C(c2ccccc2)(c2ccccc2)c2ccccc2)cn1)NC(=O)CN(CC(=O)O)Cc1ccccc1

nearest known ligand 0.50

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
SIRT2 Q8IXJ6 15/20 0.50
PTPN1 P18031 1/20 0.36
NMBR P28336 1/20 0.36
CAPN1 P07384 1/20 0.36
CTSB P07858 1/20 0.36
HPGDS O60760 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
SCHEMBL2476422 0.89 SIRT2 (0.61) SIRT2NMBR
SCHEMBL2478687 0.89 SIRT2 (0.51) SIRT2NMBR
SCHEMBL2476426 0.89 SIRT2 (0.61) SIRT2NMBR
SCHEMBL2477239 0.89 SIRT2 (0.61) SIRT2NMBR
SCHEMBL2475599 0.87 SIRT2 (0.53) SIRT2NMBR
SCHEMBL2475588 0.87 SIRT2 (0.53) SIRT2NMBR
SCHEMBL2473482 0.84 SIRT2 (0.58) SIRT2NMBR
SCHEMBL2476116 0.84 SIRT2 (0.56) SIRT2NMBR
SCHEMBL2473478 0.84 SIRT2 (0.58) SIRT2NMBR
SCHEMBL2476117 0.84 SIRT2 (0.56) 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 3 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
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