SCHEMBL8858749

SCHEMBL8858749

O=C(NCCc1cccc2ccc(OCc3ccccc3)cc12)C1CC1

nearest known ligand 0.77

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
MTNR1A P48039 19/20 0.77
MTNR1B P49286 12/20 0.77
NQO2 P16083 1/20 0.55

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
SCHEMBL7014662 0.87 MTNR1A (1.00) MTNR1AMTNR1B
SCHEMBL6247137 0.84 MTNR1A (1.00) MTNR1AMTNR1BNQO2
SCHEMBL29493844 0.84 MTNR1A (1.00) MTNR1AMTNR1BNQO2
SCHEMBL8858576 0.83 MTNR1A (0.72) MTNR1AMTNR1BNQO2
SCHEMBL29032226 0.83 MTNR1A (0.78) MTNR1AMTNR1BNQO2
SCHEMBL7024021 0.82 MTNR1A (1.00) MTNR1AMTNR1B
SCHEMBL9121394 0.82 MTNR1A (0.71) MTNR1AMTNR1B
SCHEMBL5339923 0.81 MTNR1A (0.71) MTNR1AMTNR1BNQO2
SCHEMBL8858486 0.80 MTNR1A (0.79) MTNR1AMTNR1BNQO2
SCHEMBL5929464 0.80 MTNR1A (1.00) MTNR1AMTNR1BNQO2

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-0562956-B1 Naphtylalkylamines, process for their preparation and pharmaceutical compositions containing them ADIR (FR) 1995-09-27 EP claimed
US-5420158-A Melatonin activity ADIR ET COMPAGNIE (FR) 1995-05-30 US claimed
EP-0562956-A1 Naphtylalkylamines, process for their preparation and pharmaceutical compositions containing them ADIR ET COMPAGNIE (FR) 1993-09-29 EP claimed
US-5616614-A USEFUL IN TREATMENT OF DISORDERS LINKED TO ABNORMAL MELATONIN ACTIVITY ADIR ET COMPAGNIE (FR) 1997-04-01 US disclosed
EP-0562956-B1 Naphtylalkylamines, process for their preparation and pharmaceutical compositions containing them ADIR (FR) 1995-09-27 EP disclosed
US-5420158-A Melatonin activity ADIR ET COMPAGNIE (FR) 1995-05-30 US disclosed
EP-0562956-A1 Naphtylalkylamines, process for their preparation and pharmaceutical compositions containing them ADIR ET COMPAGNIE (FR) 1993-09-29 EP disclosed