SCHEMBL16473685

SCHEMBL16473685

O=c1[nH]c(Cc2ccccc2C2=CC=CC(OC3CCC3)N2)nc2c1cnn2C1CCOCC1

nearest known ligand 0.67

Predicted protein targets (top 1)

geneUniProtsupporting neighboursconfidence
▸ PDE9A O76083 20/20 0.67

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
SCHEMBL7884196 0.80 PDE9A (1.00) PDE9A
SCHEMBL7884123 0.78 PDE9A (0.71) PDE9A
SCHEMBL7880383 0.77 PDE9A (0.77) PDE9A
SCHEMBL7876055 0.77 PDE9A (0.84) PDE9A
SCHEMBL7876909 0.77 PDE9A (1.00) PDE9A
SCHEMBL16473822 0.77 PDE9A (0.69) PDE9A
SCHEMBL7879280 0.76 PDE9A (0.82) PDE9A
SCHEMBL7881319 0.76 PDE9A (1.00) PDE9A
SCHEMBL7884512 0.76 PDE9A (1.00) PDE9A
SCHEMBL7890325 0.76 PDE9A (0.70) PDE9A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2414363-B1 1-HETEROCYCLYL-1,5-DIHYDRO-PYRAZOLO[3,4-D]PYRIMIDIN-4-ONE DERIVATIVES AND THEIR USE AS PDE9A MODULATORS BOEHRINGER INGELHEIM INT (DE) 2014-01-08 — — EP disclosed
Send feedback