SCHEMBL8109293

SCHEMBL8109293

CC(=O)NCCCC1OCC(c2cccc3cc(OCC4CC4)ccc23)CO1

nearest known ligand 0.75

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
ACACB O00763 11/20 0.75
ACACA Q13085 5/20 0.60
MTNR1A P48039 8/20 0.43
MTNR1B P49286 7/20 0.40

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
SCHEMBL9235486 1.00 ACACB (0.75) ACACBACACAMTNR1AMTNR1B
SCHEMBL4376973 0.92 ACACB (0.63) ACACBACACAMTNR1AMTNR1B
SCHEMBL4376978 0.92 ACACB (0.63) ACACBACACAMTNR1AMTNR1B
SCHEMBL8120495 0.90 ACACB (0.76) ACACBACACAMTNR1AMTNR1B
SCHEMBL8116644 0.89 ACACB (0.58) ACACBACACAMTNR1A
SCHEMBL7779969 0.88 ACACB (0.78) ACACBACACAMTNR1AMTNR1B
SCHEMBL9236434 0.88 ACACB (0.78) ACACBACACAMTNR1AMTNR1B
SCHEMBL9239113 0.88 ACACB (0.78) ACACBACACAMTNR1AMTNR1B
SCHEMBL8118807 0.87 ACACB (0.71) ACACBACACAMTNR1AMTNR1B
SCHEMBL647889 0.87 ACACB (0.57) ACACBACACAMTNR1AMTNR1B

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0686394-A1 Use of N-[[5-(naphthales-1-yl)-1,3-dioxan-2-yl]alkyl]acetamide derivatives for the preparation of medicaments for use in the treatment of neurodegenerative disorders SYNTHELABO (FR) 1995-12-13 EP claimed
EP-0461958-B1 2-(aminoalkyl)-5-(arylalkyl)1,3-dioxanderivatives their production and their use in therapeutics SYNTHELABO (FR) 1994-09-14 EP claimed
EP-0986552-A1 5-NAPHTHALEN-1-YL-1,3-DIOXANE DERIVATIVES, PREPARATION AND THERAPEUTIC APPLICATION SANOFI-SYNTHELABO (FR) 2000-03-22 EP disclosed
WO-1998055474-A1 5-NAPHTHALEN-1-YL-1,3-DIOXANE DERIVATIVES, PREPARATION AND THERAPEUTIC APPLICATION SANOFI-SYNTHELABO (FR) 1998-12-10 WO disclosed
EP-0686394-A1 Use of N-[[5-(naphthales-1-yl)-1,3-dioxan-2-yl]alkyl]acetamide derivatives for the preparation of medicaments for use in the treatment of neurodegenerative disorders SYNTHELABO (FR) 1995-12-13 EP disclosed