SCHEMBL7013097

SCHEMBL7013097

CC(=O)NC1CC1c1coc2ccc3c(c12)CCCO3

nearest known ligand 0.55

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
MTNR1A P48039 13/20 0.55
MTNR1B P49286 12/20 0.41
SMN1; SMN2 Q16637 1/20 0.38
NPSR1 Q6W5P4 1/20 0.38
CHRNA7 P36544 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
SCHEMBL7013102 1.00 MTNR1A (0.55) MTNR1AMTNR1BSMN1; SMN2NPSR1CHRNA7
SCHEMBL7004406 0.79 MTNR1A (0.49) MTNR1AMTNR1BCHRNA7
SCHEMBL7013921 0.78 MTNR1B (0.58) MTNR1AMTNR1B
SCHEMBL7013920 0.78 MTNR1B (0.58) MTNR1AMTNR1B
SCHEMBL7008448 0.78 MTNR1A (0.45) MTNR1AMTNR1B
SCHEMBL7238905 0.78 MTNR1A (0.45) MTNR1AMTNR1B
SCHEMBL7238727 0.74 MTNR1A (0.42) MTNR1AMTNR1B
SCHEMBL7238723 0.74 MTNR1A (0.42) MTNR1AMTNR1B
SCHEMBL7016214 0.73 MTNR1A (0.47) MTNR1AMTNR1B
SCHEMBL7009054 0.73 MTNR1A (0.43) MTNR1A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-6583319-B1 Treating or preventing melatoninergic disorders LES LABORATOIRES SERVIER (FR) 2003-06-24 US disclosed
EP-0994102-B1 Cyclic derivatives with a cycloalkylenic chain, process for their preparation and pharmaceutical compositions containing them SERVIER LAB (FR) 2003-03-19 EP disclosed
EP-0994102-A1 Cyclic derivatives with a cycloalkylenic chain, process for their preparation and pharmaceutical compositions containing them ADIR ET COMPAGNIE (FR) 2000-04-19 EP disclosed