SCHEMBL2669876

SCHEMBL2669876

CCCC(CCC)C(Nc1ccc(C(=O)NCCC(=O)O)cc1)c1csc2ccccc12

nearest known ligand 0.47

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
GCGR P47871 13/20 0.47
GCG P01275 6/20 0.41
HDAC6 Q9UBN7 1/20 0.40

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
SCHEMBL2669757 0.82 GCGR (0.63) GCGRGCG
SCHEMBL18863550 0.77 GCGR (0.72) GCGR
SCHEMBL719326 0.77 GCG (0.46) GCGRGCG
SCHEMBL2669988 0.76 GCGR (0.43) GCGRGCG
SCHEMBL18863590 0.76 GCGR (0.58) GCGR
SCHEMBL2669985 0.75 GCGR (0.47) GCGRGCG
SCHEMBL718054 0.74 GCGR (0.58) GCGRGCG
SCHEMBL2669798 0.72 GCG (0.48) GCGRGCGHDAC6
SCHEMBL2669917 0.71 GCGR (0.43) GCGRGCG
SCHEMBL2669764 0.69 GCGR (0.44) GCGRGCG

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