SCHEMBL8425913

SCHEMBL8425913

N#CCCC1Cc2ccccc2O1

nearest known ligand 0.47

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
HRH3 Q9Y5N1 1/20 0.43
AOC2 O75106 5/20 0.37
MAOA P21397 5/20 0.37
MAOB P27338 5/20 0.37
DAO P14920 1/20 0.37
CA2 P00918 2/20 0.35
HTR1A P08908 2/20 0.35
HTR1D P28221 1/20 0.35
CHRM2 P08172 1/20 0.34
CHRM4 P08173 1/20 0.34
CHRM5 P08912 1/20 0.34
CHRM1 P11229 1/20 0.34
CHRM3 P20309 1/20 0.34
HPGD P15428 1/20 0.34
TSHR P16473 1/20 0.34
ADRA2A P08913 1/20 0.34
ADRA2B P18089 1/20 0.34
ADRA2C P18825 1/20 0.34
SIGMAR1 Q99720 1/20 0.34

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
SCHEMBL8425962 0.84 CA2 (0.49) CA2HTR1AHTR1DADRA2AADRA2B
SCHEMBL8089401 0.83 HRH3 (0.46) HRH3AOC2MAOAMAOBDAO
SCHEMBL8425149 0.78 MAPKAPK2 (0.37) HRH3
SCHEMBL8038140 0.77 HRH3 (0.47) HRH3AOC2MAOAMAOBDAO
SCHEMBL11535632 0.77 HRH3 (0.47) HRH3AOC2MAOAMAOBDAO
SCHEMBL11200558 0.77 HRH3 (0.50) HRH3AOC2MAOAMAOBDAO
SCHEMBL17193871 0.77 HRH3 (0.47) HRH3AOC2MAOAMAOBDAO
SCHEMBL8035976 0.77 HRH3 (0.47) HRH3AOC2MAOAMAOBDAO
SCHEMBL8026169 0.77 HRH3 (0.47) HRH3AOC2MAOAMAOBDAO
SCHEMBL13638405 0.77 HRH3 (0.47) HRH3AOC2MAOAMAOBDAO

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
US-5925662-A OXIDASE INHIBITORS SYNTHELABO (FR) 1999-07-20 US disclosed
EP-0859776-A1 COMPOUNDS DERIVED FROM OXAZOLIDIN-2-ONE AND PREPARATION AND THERAPEUTICAL USE THEREOF SYNTHELABO (FR) 1998-08-26 EP disclosed
WO-1997017347-A1 COMPOUNDS DERIVED FROM OXAZOLIDIN-2-ONE AND PREPARATION AND THERAPEUTICAL USE THEREOF SYNTHELABO (FR) 1997-05-15 WO disclosed