SCHEMBL4746639

SCHEMBL4746639

CCOCC1CC(OC)(OC)C1

nearest known ligand 0.32

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
CYP2D6 P10635 1/20 0.32
SLC6A2 P23975 1/20 0.32
SLC6A4 P31645 1/20 0.32
SLC6A3 Q01959 1/20 0.32

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
SCHEMBL4749665 0.78
SCHEMBL17598123 0.77 MGAM (0.35)
SCHEMBL17112471 0.74 APLNR (0.42) CYP2D6SLC6A2SLC6A4SLC6A3
SCHEMBL5790770 0.70 CTSL (0.48)
SCHEMBL131689 0.69
SCHEMBL15645880 0.69 CYP2D6 (0.34) CYP2D6SLC6A2SLC6A4SLC6A3
SCHEMBL14486633 0.69 CYP2D6 (0.34) CYP2D6SLC6A2SLC6A4SLC6A3
SCHEMBL12695097 0.69 CYP2D6 (0.34) CYP2D6SLC6A2SLC6A4SLC6A3
SCHEMBL1864379 0.69
SCHEMBL1863100 0.69 APLNR (0.46)

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-2008119720-A1 1-(1-CYCLOBUTYL-4-PIPERIDINYL)-1,3-DIHYDRO-2H-BENZIMIDAZOL-2-ONE DERIVATIVES WHICH HAVE ACTIVITY ON THE M1 RECEPTOR AND THEIR USE IN MEDICINE GLAXO GROUP LIMITED (GB) 2008-10-09 WO disclosed
WO-2008119720-A1 1-(1-CYCLOBUTYL-4-PIPERIDINYL)-1,3-DIHYDRO-2H-BENZIMIDAZOL-2-ONE DERIVATIVES WHICH HAVE ACTIVITY ON THE M1 RECEPTOR AND THEIR USE IN MEDICINE GLAXO GROUP LIMITED (GB) 2008-10-09 WO disclosed