SCHEMBL7688170

SCHEMBL7688170

COc1ccc(N2C(=O)c3ccccc3C2=O)cc1OC1CCCC1

nearest known ligand 0.57

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
PDE4B Q07343 15/20 0.57
PDE4A P27815 14/20 0.57
PDE4C Q08493 12/20 0.57
PDE4D Q08499 12/20 0.57
NR1H3 Q13133 2/20 0.54
NR1H2 P55055 1/20 0.54

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
SCHEMBL8713399 0.99 PDE4B (0.56) PDE4BPDE4APDE4CPDE4DNR1H3
SCHEMBL8707864 0.92 PDE4B (0.53) PDE4BPDE4APDE4CPDE4DNR1H3
SCHEMBL8712873 0.91 PDE4B (0.52) PDE4BPDE4APDE4CPDE4DNR1H3
SCHEMBL6171171 0.87 PDE4B (0.50) PDE4BPDE4APDE4CPDE4DNR1H3
SCHEMBL8707692 0.86 NR1H3 (0.53) PDE4BPDE4APDE4CPDE4DNR1H3
SCHEMBL7694019 0.86 PDE4A (0.48) PDE4BPDE4APDE4CPDE4D
SCHEMBL7689616 0.84 NR1H3 (0.71) NR1H3NR1H2
SCHEMBL7694219 0.84 PDE4B (0.60) PDE4BPDE4APDE4CPDE4D
SCHEMBL8707496 0.82 PDE4B (0.46) PDE4BPDE4APDE4CPDE4D
SCHEMBL7694316 0.82 HTR2C (0.61) PDE4BPDE4APDE4CPDE4D

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
WO-2002081447-A1 3-CYCLOPENTYLOXY-4-METHOXYPHENYL-ISOTHIAZOLINONE DERIVATIVES AND THE USE THEREOF DAEWOONG PHARMACEUTICAL CO., LTD. (KR) 2002-10-17 WO disclosed
WO-2002081446-A1 3-CYCLOPENTYLOXY-4-METHOXYPHENYL-ISOINDOLINONE DERIVATIVES AND THE USE THEREOF DAEWOONG CO., LTD. (KR) 2002-10-17 WO disclosed
WO-1998042666-A1 NOVEL 3,4-DIALKOXYPHENYL DERIVATIVES AND THE USE THEREOF DAEWOONG PHARMACEUTICAL CO., LTD. (KR) 1998-10-01 WO disclosed