SCHEMBL8137642

SCHEMBL8137642

CCCOc1cnc2c(c1)c(CCNC(C)=O)cn2C

nearest known ligand 0.78

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
MTNR1A P48039 18/20 0.78
MTNR1B P49286 13/20 0.52
NQO2 P16083 2/20 0.52
ACACB O00763 1/20 0.44

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
SCHEMBL8134907 0.94 MTNR1A (0.76) MTNR1AMTNR1BNQO2
SCHEMBL8143092 0.91 MTNR1A (0.81) MTNR1AMTNR1BNQO2ACACB
SCHEMBL7244412 0.91 MTNR1A (0.70) MTNR1AMTNR1BNQO2
SCHEMBL8134992 0.87 MTNR1A (1.00) MTNR1AMTNR1BNQO2
SCHEMBL8128204 0.85 MTNR1A (0.74) MTNR1AMTNR1BNQO2
SCHEMBL7017774 0.82 MTNR1A (0.74) MTNR1AMTNR1BNQO2
SCHEMBL5346659 0.82 MTNR1A (0.66) MTNR1AMTNR1BNQO2
SCHEMBL5344076 0.81 MTNR1A (0.72) MTNR1AMTNR1BNQO2
SCHEMBL7237297 0.81 MTNR1A (0.72) MTNR1AMTNR1BNQO2
SCHEMBL8152799 0.80 MTNR1A (0.78) 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 2 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0737685-B1 Pyridine derivatives, process for their preparation and pharmaceutical compositions containing them ADIR (FR) 2000-07-19 EP disclosed
EP-0737685-A1 Pyridine derivatives, process for their preparation and pharmaceutical compositions containing them ADIR ET COMPAGNIE (FR) 1996-10-16 EP disclosed