SCHEMBL8064758

SCHEMBL8064758

CNC(=O)NCCc1cc(OS(=O)(=O)C(F)(F)F)cc2ccc(OC)cc12

nearest known ligand 0.63

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
MTNR1A P48039 16/20 0.63
MTNR1B P49286 6/20 0.53
HTR2C P28335 3/20 0.49
HTR2B P41595 1/20 0.48
TRPV1 Q8NER1 1/20 0.48
NQO2 P16083 1/20 0.47

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
SCHEMBL8064765 0.91 MTNR1A (0.64) MTNR1AMTNR1BHTR2C
SCHEMBL6246364 0.89 MTNR1A (0.65) MTNR1AMTNR1BHTR2CHTR2B
SCHEMBL6246655 0.88 MTNR1A (0.63) MTNR1AMTNR1B
SCHEMBL6249788 0.83 MTNR1A (0.54) MTNR1AMTNR1B
SCHEMBL7964472 0.83 MTNR1A (0.72) MTNR1AMTNR1BHTR2CHTR2BTRPV1
SCHEMBL8068522 0.80 MTNR1A (0.80) MTNR1AMTNR1B
SCHEMBL8961082 0.79 MTNR1A (0.71) MTNR1AMTNR1BHTR2CHTR2B
SCHEMBL8960886 0.79 MTNR1A (0.71) MTNR1AMTNR1BHTR2CHTR2B
SCHEMBL8961185 0.79 MTNR1A (0.82) MTNR1AMTNR1BHTR2CNQO2
SCHEMBL8961221 0.78 MTNR1A (0.80) MTNR1AMTNR1BHTR2CHTR2BNQO2

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
US-6143789-A ENANTIOMORPHS ADIR ET COMPAGNIE (FR) 2000-11-07 US disclosed
EP-0919541-A1 Naphthalene compounds, process for their preparation and their pharmaceutical compositions ADIR ET COMPAGNIE (FR) 1999-06-02 EP disclosed