SCHEMBL5711046

SCHEMBL5711046

CC(C)(C)N1CCCCC1C=O

nearest known ligand 0.36

Predicted protein targets (top 1)

geneUniProtsupporting neighboursconfidence
HTT P42858 1/20 0.36

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
SCHEMBL13448442 0.94 HTT (0.38) HTT
SCHEMBL12435686 0.94 HTT (0.38) HTT
SCHEMBL1915246 0.85 HTT (0.50) HTT
SCHEMBL16884605 0.75 LMNA (0.32)
SCHEMBL14127771 0.74 HTT (0.38) HTT
SCHEMBL8130598 0.72 HTT (0.33) HTT
SCHEMBL88583 0.71
SCHEMBL12018255 0.71
SCHEMBL14087966 0.71
SCHEMBL12312754 0.71

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
EP-1718632-A1 PYRIMIDINE DERIVATIVES AS OREXIN RECEPTOR ANTAGONISTS Sanofi-Aventis (FR) 2006-11-08 EP disclosed
WO-2005075458-A1 PYRIMIDINE DERIVATIVES AS OREXIN RECEPTORS ANTAGONISTS SANOFI-AVENTIS (FR) 2005-08-18 WO disclosed