SCHEMBL5319375

SCHEMBL5319375

O=C1c2c(Cl)cc(CCCn3cccc3)cc2CN1Cc1ccc(Oc2ccccc2)cc1

nearest known ligand 0.37

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
LIPG Q9Y5X9 3/20 0.37
PARP1 P09874 2/20 0.35
PARP2 Q9UGN5 1/20 0.35
CYP2C9 P11712 1/20 0.35
PPARG P37231 1/20 0.35
FAAH O00519 2/20 0.35
MGLL Q99685 1/20 0.35
EGLN1 Q9GZT9 1/20 0.34
DAO P14920 1/20 0.34
DRD3 P35462 1/20 0.34
KCNH2 Q12809 1/20 0.34
GRM2 Q14416 1/20 0.34
PREP P48147 1/20 0.33

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
SCHEMBL2022865 0.87 HRH3 (0.45)
SCHEMBL2019146 0.87 SIGMAR1 (0.43)
SCHEMBL2024648 0.84 LIPG (0.37) LIPGPARP1CYP2C9PPARGFAAH
SCHEMBL8272736 0.80 NPC1 (0.46) FAAH
SCHEMBL8272733 0.80 MCHR1 (0.41) PARP1CYP2C9PPARGFAAHMGLL
SCHEMBL8272058 0.80 HRH3 (0.48) FAAHPREP
SCHEMBL2022587 0.79 MEN1 (0.41) PARP1CYP2C9PPARGFAAHMGLL
SCHEMBL2028181 0.77 SIGMAR1 (0.41) GRM2
SCHEMBL2022411 0.76 PARP1 (0.52) PARP1EGLN1PREP
SCHEMBL12441927 0.75 PARP1 (0.40) LIPGPARP1PARP2DAODRD3

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
EP-1778634-A1 ISOINDOLONE COMPOUNDS AND THEIR USE AS METABOTROPIC GLUTAMATE RECEPTOR POTENTIATORS AstraZeneca AB (SE) 2007-05-02 EP disclosed
WO-2006020879-A1 ISOINDOLONE COMPOUNDS AND THEIR USE AS METABOTROPIC GLUTAMATE RECEPTOR POTENTIATORS ASTRAZENECA AB (SE) 2006-02-23 WO disclosed