SCHEMBL27344744

SCHEMBL27344744

COc1cccc(N2CCN(CCN3Cc4cc(OC)c(OC)cc4C3=O)CC2)c1

nearest known ligand 0.58

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
DRD2 P14416 9/20 0.58
DRD3 P35462 4/20 0.58
DRD1 P21728 1/20 0.58
HTR1A P08908 9/20 0.56
KCNH2 Q12809 2/20 0.55
DRD4 P21917 3/20 0.53
HTR7 P34969 5/20 0.52
HTR2A P28223 3/20 0.52
HTR6 P50406 3/20 0.52
DRD5 P21918 1/20 0.48

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
SCHEMBL13448963 0.90 DRD3 (0.58) DRD2DRD3DRD1HTR1ADRD4
SCHEMBL21250682 0.84 DRD3 (0.65) DRD2DRD3DRD1HTR1ADRD4
SCHEMBL27310809 0.83 HTR1A (0.71) DRD2DRD3DRD1HTR1AKCNH2
SCHEMBL13448959 0.83 DRD2 (0.66) DRD2DRD3DRD1HTR1ADRD4
SCHEMBL2027865 0.83 DRD3 (0.70) DRD2DRD3DRD1HTR1ADRD4
SCHEMBL17898233 0.81 DRD3 (0.53) DRD2DRD3DRD1HTR1ADRD4
SCHEMBL13448989 0.78 DRD2 (0.69) DRD2DRD3DRD1DRD4HTR7
SCHEMBL13448958 0.77 DRD3 (0.67) DRD2DRD3DRD1HTR1ADRD4
SCHEMBL13449000 0.77 DRD3 (0.77) DRD2DRD3DRD1HTR1ADRD4
SCHEMBL13448967 0.77 DRD3 (0.80) DRD2DRD3DRD1HTR1ADRD4

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-101039907-B Isoindolone compounds and their use as metabotropic glutamate receptor potentiators ASTRAZENECA AB 2011-02-23 CN claimed
CN-101039907-A Isoindolone compounds and their use as metabotropic glutamate receptor potentiators ASTRAZENECA AB (SE) 2007-09-19 CN claimed
CN-102134214-B Isoindolone compounds and their use as metabotropic glutamate receptor potentiators ASTRAZENECA AB 2013-05-22 CN disclosed
CN-102134214-A Isoindolone compounds and their use as metabotropic glutamate receptor potentiators ASTRAZENECA SWEDEN AB 2011-07-27 CN disclosed
CN-101039907-B Isoindolone compounds and their use as metabotropic glutamate receptor potentiators ASTRAZENECA AB 2011-02-23 CN disclosed
CN-101039907-A Isoindolone compounds and their use as metabotropic glutamate receptor potentiators ASTRAZENECA AB (SE) 2007-09-19 CN disclosed
CN-1049654-C Piperazine derivatives DAIICHI SEIYAKU CO (JP) 2000-02-23 CN disclosed