SCHEMBL2669798

SCHEMBL2669798

CCCC(CCC)C(Nc1ccc(C(=O)NCCC(=O)O)cc1)c1nc2ccccc2n1C

nearest known ligand 0.48

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
GCG P01275 9/20 0.48
GCGR P47871 5/20 0.47
HDAC6 Q9UBN7 1/20 0.46
GAA P10253 1/20 0.45
HTT P42858 1/20 0.45
MEN1 O00255 1/20 0.44
KMT2A Q03164 1/20 0.44
TP53 P04637 1/20 0.42

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
SCHEMBL718932 0.79 GCGR (0.49) GCGGCGRHDAC6GAA
SCHEMBL2669985 0.77 GCGR (0.47) GCGGCGR
SCHEMBL721582 0.75 GCGR (0.46) GCGGCGRHDAC6GAA
SCHEMBL2669917 0.74 GCGR (0.43) GCGGCGR
SCHEMBL2669876 0.72 GCGR (0.47) GCGGCGRHDAC6
SCHEMBL2669757 0.72 GCGR (0.63) GCGGCGR
SCHEMBL2669988 0.71 GCGR (0.43) GCGGCGR
SCHEMBL721583 0.68 GCG (0.42) GCGGCGRHDAC6GAAMEN1
SCHEMBL21545006 0.66 GCGR (0.53) GCGGCGR
SCHEMBL21545024 0.66 GCGR (0.53) GCGGCGR

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
WO-2009110520-A1 HETEROCYCLIC COMPOUND 武田薬品工業株式会社 (JP) 2009-09-11 WO disclosed