SCHEMBL8153166

SCHEMBL8153166

CCCNC(=S)NCCc1cn(C)c2ncc(OC)cc12

nearest known ligand 0.71

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
MTNR1A P48039 18/20 0.71
MTNR1B P49286 17/20 0.53
NQO2 P16083 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
SCHEMBL8146021 0.94 MTNR1A (0.68) MTNR1AMTNR1BNQO2
SCHEMBL8146661 0.93 MTNR1A (0.71) MTNR1AMTNR1BNQO2
SCHEMBL8152799 0.89 MTNR1A (0.78) MTNR1AMTNR1BNQO2
SCHEMBL8136431 0.84 MTNR1A (0.78) MTNR1AMTNR1BNQO2
SCHEMBL8134992 0.83 MTNR1A (1.00) MTNR1AMTNR1BNQO2
SCHEMBL8150330 0.83 MTNR1A (0.74) MTNR1AMTNR1BNQO2
SCHEMBL8152291 0.82 MTNR1A (0.78) MTNR1AMTNR1BNQO2
SCHEMBL8137636 0.81 MTNR1A (0.79) MTNR1AMTNR1BNQO2
SCHEMBL8137814 0.80 MTNR1A (0.70) MTNR1AMTNR1BNQO2
SCHEMBL8140872 0.77 MTNR1A (0.69) 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