SCHEMBL8553393

SCHEMBL8553393

Cc1c(CO)nc2c(=O)[nH]c3ccccc3n12

nearest known ligand 0.49

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PDE2A O00408 1/20 0.49
PDE6D O43924 1/20 0.49
PDE8A O60658 1/20 0.49
PDE5A O76074 1/20 0.49
PDE9A O76083 1/20 0.49
PDE8B O95263 1/20 0.49
PDE6A P16499 1/20 0.49
PDE6G P18545 1/20 0.49
PDE4A P27815 1/20 0.49
PDE6B P35913 1/20 0.49
PDE6C P51160 1/20 0.49
PDE1A P54750 1/20 0.49
PDE1B Q01064 1/20 0.49
PDE4B Q07343 1/20 0.49
PDE4C Q08493 1/20 0.49
PDE4D Q08499 1/20 0.49
PDE3B Q13370 1/20 0.49
PDE7A Q13946 1/20 0.49
PDE6H Q13956 1/20 0.49
PDE1C Q14123 1/20 0.49

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
SCHEMBL8557983 0.84 DAO (0.43) KDM4EALDH1A1HPGDADORA3ADORA1
SCHEMBL8558719 0.82 ADORA3 (0.50) PDE5APDE9AADORA3ADORA1
SCHEMBL9052411 0.81 POLB (0.55) PDE2APDE6DPDE8APDE5APDE9A
SCHEMBL8557784 0.79 PDE5A (0.47) PDE2APDE5APDE9AALDH1A1MAPT
SCHEMBL8034425 0.79 ADORA3 (0.61) PDE2APDE6DPDE8APDE5APDE9A
SCHEMBL8554710 0.77 POLB (0.50) PDE2APDE6DPDE8APDE5APDE9A
SCHEMBL8553821 0.75 POLB (0.49) PDE2APDE6DPDE8APDE5APDE9A
SCHEMBL8555929 0.75 POLB (0.46) PDE2APDE6DPDE8APDE5APDE9A
SCHEMBL8557227 0.74 ADORA3 (0.54) PDE2APDE6DPDE8APDE5APDE9A
SCHEMBL8555643 0.74 POLB (0.47) PDE2APDE6DPDE8APDE5APDE9A

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-0691970-B1 IMIDAZOLOQUINOXALINONE DERIVATIVES AS EAA ANTAGONISTS BASF AG (DE) 1998-11-11 EP disclosed