SCHEMBL7005548

SCHEMBL7005548

CCCC(=O)NCC1CC1c1cccc2ccc(OC)cc12

nearest known ligand 0.57

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
MTNR1A P48039 13/20 0.57
MTNR1B P49286 7/20 0.57

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
SCHEMBL7005551 1.00 MTNR1A (0.57) MTNR1AMTNR1B
SCHEMBL7235613 0.83 MTNR1A (0.76) MTNR1AMTNR1B
SCHEMBL7007743 0.83 MTNR1A (0.76) MTNR1AMTNR1B
SCHEMBL8089383 0.81 MTNR1A (0.53) MTNR1AMTNR1B
SCHEMBL8089386 0.81 MTNR1A (0.53) MTNR1AMTNR1B
SCHEMBL8088398 0.81 MTNR1A (0.53) MTNR1AMTNR1B
SCHEMBL8088400 0.81 MTNR1A (0.53) MTNR1AMTNR1B
SCHEMBL8089150 0.81 HTR2A (0.55) MTNR1AMTNR1B
SCHEMBL8088925 0.81 HTR2A (0.55) MTNR1AMTNR1B
SCHEMBL8088983 0.81 MTNR1B (0.52) MTNR1AMTNR1B

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