SCHEMBL10143741

SCHEMBL10143741

COc1ccc(Nc2nc(Nc3cc(C)ccc3C)cc(N3CCS(=O)(=O)CC3)n2)cc1

nearest known ligand 0.79

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
GALR2 O43603 14/20 0.79
AURKA O14965 2/20 0.54
GALR1 P47211 5/20 0.50
JAK2 O60674 1/20 0.48
JAK3 P52333 1/20 0.48
SLC2A1 P11166 1/20 0.44

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
SCHEMBL10143391 0.88 GALR2 (1.00) GALR2AURKAGALR1SLC2A1
SCHEMBL10143469 0.87 GALR2 (0.82) GALR2AURKAGALR1
SCHEMBL10143487 0.87 GALR2 (0.82) GALR2AURKAGALR1
SCHEMBL10143662 0.87 GALR2 (0.82) GALR2AURKAGALR1SLC2A1
SCHEMBL10143455 0.86 GALR2 (0.80) GALR2AURKAGALR1
SCHEMBL10143620 0.84 GALR2 (0.78) GALR2AURKAGALR1
SCHEMBL10143754 0.83 GALR2 (0.82) GALR2AURKAGALR1
SCHEMBL10143474 0.83 GALR2 (0.86) GALR2AURKAGALR1SLC2A1
SCHEMBL10143471 0.82 GALR2 (0.70) GALR2AURKAGALR1
SCHEMBL10143637 0.81 GALR2 (0.73) GALR2AURKAGALR1

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-2012009258-A2 PEPTIDOMIMETIC GALANIN RECEPTOR MODULATORS ROBERTS EDWARD (US) 2012-01-19 WO disclosed