SCHEMBL8705200

SCHEMBL8705200

COc1ccc2ccccc2c1CCNC(=O)C(F)(F)F

nearest known ligand 1.00 ✓ in ChEMBL — recovers established targets

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
MTNR1A P48039 3/20 0.58
MTNR1B P49286 3/20 0.58
SLC2A1 P11166 1/20 0.50

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
SCHEMBL8873933 1.00 MTNR1A (0.58) MTNR1AMTNR1BSLC2A1
SCHEMBL8186004 0.84 MTNR1A (0.61) MTNR1AMTNR1B
SCHEMBL27229065 0.83 MTNR1A (0.53) MTNR1AMTNR1B
SCHEMBL3915704 0.82 MTNR1A (0.73) MTNR1AMTNR1B
SCHEMBL5344998 0.82 MTNR1A (0.50) MTNR1AMTNR1B
SCHEMBL8708804 0.81 MTNR1A (0.61) MTNR1AMTNR1B
SCHEMBL6076454 0.81 MTNR1A (0.49) MTNR1AMTNR1BSLC2A1
SCHEMBL5351881 0.81 MTNR1A (0.49) MTNR1AMTNR1B
SCHEMBL5343898 0.81 MTNR1A (0.49) MTNR1AMTNR1B
SCHEMBL6077489 0.80 NCEH1 (0.45) MTNR1AMTNR1BSLC2A1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0591057-B1 Arylalkyl(thio)amides with melatonine receptor selectivity and process for their preparation ADIR (FR) 1996-07-10 EP claimed
US-5464872-A Sleep disorders ADIR ET COMPAGNIE (FR) 1995-11-07 US claimed
EP-0591057-A1 Arylalkyl(thio)amides with melatonine receptor selectivity and process for their preparation ADIR ET COMPAGNIE (FR) 1994-04-06 EP claimed
US-5708020-A FOR TREATING SLEEP DISORDERS ADIR ET COMPAGNIE (FR) 1998-01-13 US disclosed
EP-0591057-B1 Arylalkyl(thio)amides with melatonine receptor selectivity and process for their preparation ADIR (FR) 1996-07-10 EP disclosed
US-5464872-A Sleep disorders ADIR ET COMPAGNIE (FR) 1995-11-07 US disclosed
EP-0591057-A1 Arylalkyl(thio)amides with melatonine receptor selectivity and process for their preparation ADIR ET COMPAGNIE (FR) 1994-04-06 EP disclosed