SCHEMBL8961269

SCHEMBL8961269

CCC(=O)c1cc(CCNC(=O)C2CC2)c2ccccc2c1

nearest known ligand 0.59

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
MTNR1A P48039 16/20 0.57
MTNR1B P49286 6/20 0.53
NQO2 P16083 1/20 0.53

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
SCHEMBL8960838 0.97 MTNR1A (0.58) MTNR1AMTNR1BNQO2
SCHEMBL8961222 0.89 MTNR1A (0.71) MTNR1AMTNR1BNQO2
SCHEMBL8961285 0.88 MTNR1A (0.56) MTNR1AMTNR1BNQO2
SCHEMBL8961233 0.86 MTNR1A (0.54) MTNR1AMTNR1BNQO2
SCHEMBL8960952 0.85 MTNR1A (0.69) MTNR1AMTNR1BNQO2
SCHEMBL8961119 0.85 MTNR1A (0.65) MTNR1AMTNR1BNQO2
SCHEMBL8960863 0.85 MTNR1A (0.57) MTNR1AMTNR1BNQO2
SCHEMBL8961109 0.84 MTNR1A (0.71) MTNR1AMTNR1BNQO2
SCHEMBL8961207 0.83 MTNR1A (0.82) MTNR1AMTNR1BNQO2
SCHEMBL8961217 0.81 MTNR1A (0.56) 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 1 patent. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-5552418-A FOR TREATING DISORDERS OF THE MELATONINERGIC SYSTEM ADIR ET COMPAGNIE (FR) 1996-09-03 US disclosed