SCHEMBL9304487

SCHEMBL9304487

CCC([11Au])N1C(=O)C=CC1=O

nearest known ligand 0.42

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MGLL Q99685 11/20 0.42
ALDH1A1 P00352 3/20 0.42
BLM P54132 2/20 0.42
LMNA P02545 2/20 0.42
MAPT P10636 2/20 0.42
NPSR1 Q6W5P4 2/20 0.42
GMNN O75496 1/20 0.42
THPO P40225 1/20 0.42
PMP22 Q01453 1/20 0.42
GSK3A P49840 2/20 0.36
GSK3B P49841 2/20 0.36
FAAH O00519 4/20 0.34
PTGS1 P23219 3/20 0.34
PTGS2 P35354 3/20 0.34
HPGD P15428 2/20 0.32
CYP1A2 P05177 1/20 0.32
CYP2C19 P33261 1/20 0.32
WRN Q14191 1/20 0.32
HIF1A Q16665 1/20 0.32
HSP90AA1 P07900 1/20 0.31

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
SCHEMBL1535518 0.75 MGLL (0.46) MGLLALDH1A1BLMLMNAMAPT
SCHEMBL7882002 0.75 MGLL (0.46) MGLLALDH1A1BLMLMNAMAPT
SCHEMBL3863566 0.73 MGLL (0.44) MGLLALDH1A1BLMLMNAMAPT
SCHEMBL209740 0.73 MGLL (0.44) MGLLALDH1A1BLMLMNAMAPT
SCHEMBL324881 0.71 MGLL (0.42) MGLLALDH1A1BLMLMNAMAPT
SCHEMBL1887391 0.71 MGLL (0.42) MGLLALDH1A1BLMLMNAMAPT
SCHEMBL1554094 0.71 MGLL (0.42) MGLLALDH1A1BLMLMNAMAPT
SCHEMBL28688927 0.71 MGLL (0.42) MGLLALDH1A1BLMLMNAMAPT
SCHEMBL9460127 0.70 MGLL (0.35) MGLLALDH1A1BLMLMNAMAPT
SCHEMBL17924868 0.70 MGLL (0.41) MGLLALDH1A1BLMLMNAMAPT

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
US-5360895-A Derivatized gold clusters and antibody-gold cluster conjugates ASSOCIATED UNIVERSITIES, INC. (US) 1994-11-01 US disclosed