SCHEMBL6848552

SCHEMBL6848552

CCCN(CC(=O)N1CCc2sccc2C1c1ccccc1)C(=O)c1ccccc1

nearest known ligand 0.58

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
HHAT Q5VTY9 5/20 0.58
CNR1 P21554 2/20 0.52
LHCGR P22888 3/20 0.47
MAPK1 P28482 1/20 0.42
NPSR1 Q6W5P4 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
SCHEMBL2308896 0.78 HHAT (0.63) HHATCNR1LHCGRMAPK1NPSR1
SCHEMBL3365755 0.76 HHAT (0.73) HHATLHCGRMAPK1NPSR1
SCHEMBL3367746 0.75 HHAT (0.69) HHATLHCGRMAPK1NPSR1
SCHEMBL2306467 0.75 HHAT (0.58) HHATCNR1LHCGRMAPK1NPSR1
SCHEMBL21764028 0.75 HHAT (1.00) HHATLHCGRMAPK1NPSR1
SCHEMBL3365878 0.74 HHAT (0.67) HHATCNR1LHCGR
SCHEMBL3365448 0.73 HHAT (0.66) HHATLHCGRMAPK1NPSR1
SCHEMBL2308216 0.73 HHAT (0.59) HHATCNR1LHCGR
SCHEMBL2306201 0.73 HHAT (0.56) HHATCNR1LHCGRMAPK1NPSR1
SCHEMBL3366109 0.73 HHAT (0.65) HHATLHCGRMAPK1NPSR1

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 2 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2011020849-A1 CYTOHESIN INHIBITORS RHEINISCHE FRIEDRICH-WILHELMS UNIVERSITÄT (DE) 2011-02-24 WO disclosed
EP-2286808-A1 Cytohesin inhibitors Rheinische Friedrich-Wilhelms Universität (DE) 2011-02-23 EP disclosed