SCHEMBL7016158

SCHEMBL7016158

CC(=O)NCCc1c[nH]c2ncc(-c3ccc4occ(CCNC(C)=O)c4c3)cc12

nearest known ligand 0.58

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
MTNR1A P48039 16/20 0.58
MTNR1B P49286 8/20 0.56
NQO2 P16083 3/20 0.54
NOTUM Q6P988 1/20 0.46

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
SCHEMBL7016697 0.85 MTNR1A (0.70) MTNR1AMTNR1BNQO2
SCHEMBL7015300 0.85 MTNR1A (0.62) MTNR1AMTNR1BNQO2NOTUM
SCHEMBL7022005 0.84 MTNR1A (0.65) MTNR1AMTNR1BNQO2NOTUM
SCHEMBL8134979 0.82 MTNR1A (0.64) MTNR1AMTNR1BNOTUM
SCHEMBL7018584 0.80 MTNR1A (0.71) MTNR1AMTNR1BNQO2
SCHEMBL7021391 0.80 MTNR1A (0.59) MTNR1AMTNR1BNOTUM
SCHEMBL8126316 0.79 MTNR1A (0.65) MTNR1AMTNR1BNQO2
SCHEMBL7023396 0.76 MTNR1A (0.74) MTNR1AMTNR1BNQO2NOTUM
SCHEMBL7016806 0.75 MTNR1A (0.77) MTNR1AMTNR1BNQO2
SCHEMBL5346189 0.75 MTNR1A (0.71) MTNR1AMTNR1BNQO2NOTUM

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1057826-B1 Substituted dimeric carboxamide derivatives, method for preparing them, and pharmaceutical compositions containing them SERVIER LAB (FR) 2003-04-16 EP claimed
US-6310074-B1 TREATING MELATONINERGIC DISORDERS ADIR ET COMPAGNIE (FR) 2001-10-30 US claimed
EP-1057826-A1 Substituted dimeric carboxamide derivatives, method for preparing them, and pharmaceutical compositions containing them ADIR ET COMPAGNIE (FR) 2000-12-06 EP claimed
EP-1057826-B1 Substituted dimeric carboxamide derivatives, method for preparing them, and pharmaceutical compositions containing them SERVIER LAB (FR) 2003-04-16 EP disclosed
US-6310074-B1 TREATING MELATONINERGIC DISORDERS ADIR ET COMPAGNIE (FR) 2001-10-30 US disclosed
EP-1057826-A1 Substituted dimeric carboxamide derivatives, method for preparing them, and pharmaceutical compositions containing them ADIR ET COMPAGNIE (FR) 2000-12-06 EP disclosed