SCHEMBL15870218

SCHEMBL15870218

COc1ccc2c(c1)O[C@@H](CN1CCC(CCNC(=O)O)CC1)CO2

nearest known ligand 0.68

Predicted protein targets (top 1)

geneUniProtsupporting neighboursconfidence
MTNR1A P48039 1/20 0.61

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
SCHEMBL15870258 0.85
SCHEMBL15870253 0.83
SCHEMBL6980920 0.77 ADRA2A (0.55) MTNR1A
SCHEMBL7200942 0.76 MTNR1A (1.00) MTNR1A
SCHEMBL15870213 0.76 HTR1A (0.52)
SCHEMBL17272716 0.76 HTR1A (0.52)
SCHEMBL8381361 0.76 ADRA2C (0.48) MTNR1A
SCHEMBL6980987 0.76 ADRA2C (0.48) MTNR1A
SCHEMBL11107814 0.76 DRD2 (0.56) MTNR1A
SCHEMBL17272739 0.72

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-2014106660-A1 NOVEL BENZODIOXANE-PIPERIDINE DERIVATIVES AND THERAPEUTIC USES THEREOF FOR THE TREATMENT OF NEUROPSYCHIATRIC DISORDERS PIERRE FABRE MEDICAMENT (FR) 2014-07-10 WO disclosed