SCHEMBL8168593

SCHEMBL8168593

CC(=O)NCCc1csc2ccc3c(c12)CCCO3

nearest known ligand 0.65

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
MTNR1A P48039 19/20 0.65
MTNR1B P49286 15/20 0.65

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
SCHEMBL8169874 0.89 MTNR1A (0.52) MTNR1AMTNR1B
SCHEMBL8168177 0.89 MTNR1A (0.52) MTNR1AMTNR1B
SCHEMBL8168656 0.87 MTNR1A (0.52) MTNR1AMTNR1B
SCHEMBL8161912 0.86 MTNR1A (0.50) MTNR1AMTNR1B
SCHEMBL8162108 0.85 MTNR1A (0.54) MTNR1AMTNR1B
SCHEMBL8161715 0.79 MTNR1A (0.47) MTNR1AMTNR1B
SCHEMBL1387212 0.79 MTNR1A (1.00) MTNR1AMTNR1B
SCHEMBL7797256 0.79 MTNR1A (1.00) MTNR1AMTNR1B
SCHEMBL8168310 0.78 HTR2C (0.57) MTNR1AMTNR1B
SCHEMBL4688022 0.78 MTNR1A (0.65) 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 2 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-6071946-A FOR TREATING DISORDERS OF THE MELATONINERGIC SYSTEM, SLEEP DISORDERS, CIRCADIAN RHYTHM DISORDERS ADIR ET COMPAGNIE (FR) 2000-06-06 US disclosed
US-5998461-A SLEEP DISORDERS ADIR ET COMPAGNIE (FR) 1999-12-07 US disclosed