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SCHEMBL2469716

SCHEMBL2469716

CC(C)(C)OC(=O)[C@H](Cc1cn(C(c2ccccc2)(c2ccccc2)c2ccccc2)cn1)NC(=O)CN(CCCc1ccccc1)CC(=O)O

nearest known ligand 0.51

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
▸ SIRT2 Q8IXJ6 14/20 0.51
▸ MMP1 P03956 1/20 0.39
▸ MMP3 P08254 1/20 0.39
▸ MMP9 P14780 1/20 0.39
▸ POLB P06746 1/20 0.38
▸ MAPT P10636 1/20 0.38
▸ TDP1 Q9NUW8 1/20 0.38
▸ NMBR P28336 1/20 0.37
▸ MAOA P21397 1/20 0.37

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
SCHEMBL2469722 1.00 SIRT2 (0.51) SIRT2MMP1MMP3MMP9POLB
SCHEMBL2475651 0.94 SIRT2 (0.52) SIRT2MMP1MMP3MMP9POLB
SCHEMBL2475645 0.94 SIRT2 (0.52) SIRT2MMP1MMP3MMP9POLB
SCHEMBL2474591 0.93 SIRT2 (0.59) SIRT2NMBR
SCHEMBL2474587 0.93 SIRT2 (0.59) SIRT2NMBR
SCHEMBL2475599 0.91 SIRT2 (0.53) SIRT2POLBMAPTTDP1NMBR
SCHEMBL2475588 0.91 SIRT2 (0.53) SIRT2POLBMAPTTDP1NMBR
SCHEMBL2472940 0.88 SIRT2 (0.49) SIRT2MMP1MMP3MMP9NMBR
SCHEMBL2472735 0.85 SIRT2 (0.53) SIRT2POLBMAPTTDP1NMBR
SCHEMBL2472734 0.85 SIRT2 (0.53) SIRT2POLBMAPTTDP1NMBR

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-2371421-A1 Ligands of insulin degrading enzyme and their uses Université de Lille 2 Droit et Santé (FR) 2011-10-05 — — EP disclosed