SCHEMBL8616007

SCHEMBL8616007

COc1ccc2cccc(CON3C(=O)c4ccccc4C3=O)c2c1

nearest known ligand 0.53

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
MTNR1A P48039 13/20 0.53
HTR2A P28223 2/20 0.49
RECQL P46063 1/20 0.49
MTNR1B P49286 4/20 0.48
NQO2 P16083 4/20 0.47
HTR2C P28335 1/20 0.47
HTR2B P41595 1/20 0.47
ALDH1A1 P00352 1/20 0.47
HTT P42858 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
SCHEMBL5558965 0.82 ALDH1A1 (0.57) ALDH1A1HTT
SCHEMBL29421589 0.80 LMNA (0.63) MTNR1AHTR2AMTNR1BNQO2HTR2C
SCHEMBL121145 0.80 LMNA (0.63) MTNR1AHTR2AMTNR1BNQO2HTR2C
SCHEMBL8357994 0.79 RECQL (0.53) RECQLALDH1A1HTT
SCHEMBL31118998 0.78 RECQL (0.52) RECQLALDH1A1HTT
SCHEMBL31118985 0.77 RECQL (0.48) RECQLALDH1A1HTT
SCHEMBL5524437 0.76 NR1H2 (0.58) RECQLALDH1A1
SCHEMBL12013659 0.75 HTR2A (0.65) MTNR1AHTR2AMTNR1BNQO2HTR2C
SCHEMBL3248269 0.74 HTR2A (0.54) MTNR1AHTR2AMTNR1BNQO2HTR2C
SCHEMBL8639904 0.74 MTNR1A (0.64) MTNR1AHTR2AMTNR1BNQO2HTR2C

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 3 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0709371-B1 O-arylmethyl N-(thio)acyl hydroxylamines as ligands for the melatonine receptors, their processes of preparation and the pharmaceutical compositions containing them ADIR (FR) 1998-05-06 EP disclosed
US-5612368-A SKIN DISORDERS, MELATONINERGIC SYSTEMS, ANTIARRHYTHMIA AGENTS OR ANTIISCHEMIC AGENTS ADIR ET COMPAGNIE (FR) 1997-03-18 US disclosed
EP-0709371-A1 O-arylmethyl N-(thio)acyl hydroxylamines as ligands for the melatonine receptors, their processes of preparation and the pharmaceutical compositions containing them ADIR ET COMPAGNIE (FR) 1996-05-01 EP disclosed