SCHEMBL8265406

SCHEMBL8265406

CC(C)(C(NC(=O)c1ccc(F)cc1C(F)(F)F)C1=CC=CCC1)N1CCCC1

nearest known ligand 0.39

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
SCN9A Q15858 11/20 0.36
WDR5 P61964 8/20 0.34

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
SCHEMBL3238244 0.81 SLC6A9 (0.41) SCN9A
SCHEMBL8264436 0.76 SCN9A (0.34) SCN9AWDR5
SCHEMBL3243610 0.71 SLC6A9 (0.48)
SCHEMBL3244231 0.70 SLC6A9 (0.48)
SCHEMBL13761298 0.70 NPSR1 (0.47) SCN9AWDR5
SCHEMBL4932990 0.64 PPARG (0.40) SCN9AWDR5
SCHEMBL3905217 0.64 GAA (0.41) SCN9AWDR5
SCHEMBL22847896 0.64 POLB (0.47) WDR5
SCHEMBL1417617 0.63 KMT2A (0.49)
SCHEMBL8265669 0.63

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-2006067423-A1 GLYCINE TRANSPORT INHIBITORS GLAXO GROUP LIMITED (GB) 2006-06-29 WO disclosed