SCHEMBL4031838

SCHEMBL4031838

CC(=O)NCCc1cccc2ccc(F)cc12

nearest known ligand 0.75

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
MTNR1A P48039 19/20 0.75
MTNR1B P49286 16/20 0.75
NQO2 P16083 6/20 0.68
HTR2C P28335 1/20 0.68
HTR2B P41595 1/20 0.68

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
SCHEMBL7016328 0.86 MTNR1A (1.00) MTNR1AMTNR1BNQO2HTR2CHTR2B
SCHEMBL1688124 0.84 MTNR1A (0.77) MTNR1AMTNR1BNQO2HTR2CHTR2B
SCHEMBL4043404 0.84 MTNR1A (1.00) MTNR1AMTNR1BNQO2HTR2CHTR2B
SCHEMBL30449793 0.84 MTNR1A (1.00) MTNR1AMTNR1BNQO2HTR2CHTR2B
SCHEMBL5350745 0.84 MTNR1A (0.67) MTNR1AMTNR1BNQO2HTR2CHTR2B
SCHEMBL5339739 0.83 MTNR1A (0.75) MTNR1AMTNR1BNQO2HTR2CHTR2B
SCHEMBL3955906 0.83 MTNR1A (0.75) MTNR1AMTNR1BNQO2HTR2CHTR2B
SCHEMBL5351417 0.83 MTNR1A (0.75) MTNR1AMTNR1BNQO2HTR2CHTR2B
SCHEMBL14314349 0.82 MTNR1A (0.73) MTNR1AMTNR1BNQO2HTR2CHTR2B
SCHEMBL5340299 0.82 MTNR1A (0.81) MTNR1AMTNR1BNQO2HTR2CHTR2B

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
WO-2009022062-A1 NOVEL NAPHTHALENE DERIVATIVES, PROCESS FOR THE PREPARATION THEREOF AND PHARMACEUTICAL COMPOSITIONS CONTAINING SAME LES LABORATOIRES SERVIER (FR) 2009-02-19 WO disclosed
WO-2009022062-A1 NOVEL NAPHTHALENE DERIVATIVES, PROCESS FOR THE PREPARATION THEREOF AND PHARMACEUTICAL COMPOSITIONS CONTAINING SAME LES LABORATOIRES SERVIER (FR) 2009-02-19 WO disclosed