SCHEMBL5411091

SCHEMBL5411091

CNS(=O)(=O)c1cn(C)c(-c2c3c(=O)n(C)c(=O)n(CC(C)C)c3nn2Cc2cccc3ccccc23)n1

nearest known ligand 0.64

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
SLC16A1 P53985 3/20 0.49
CYP2C9 P11712 1/20 0.41
MAPKAPK2 P49137 1/20 0.41
CAMK2B Q13554 1/20 0.41
HIPK4 Q8NE63 1/20 0.41
PDE5A O76074 1/20 0.40
PDE3B Q13370 1/20 0.40
PDE3A Q14432 1/20 0.40

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
SCHEMBL5411254 0.92 SLC16A1 (0.47) SLC16A1CYP2C9MAPKAPK2CAMK2BHIPK4
SCHEMBL5411101 0.91 SLC16A1 (0.50) SLC16A1CYP2C9MAPKAPK2CAMK2BHIPK4
SCHEMBL5411346 0.90 SLC16A1 (0.46) SLC16A1CYP2C9MAPKAPK2CAMK2BHIPK4
SCHEMBL5405277 0.88 SLC16A1 (0.47) SLC16A1CYP2C9MAPKAPK2CAMK2BHIPK4
SCHEMBL5417883 0.84 SLC16A1 (0.45) SLC16A1CYP2C9MAPKAPK2CAMK2BHIPK4
SCHEMBL5400603 0.81 SLC16A1 (0.52) SLC16A1CYP2C9MAPKAPK2CAMK2BHIPK4
SCHEMBL5400640 0.81 SLC16A1 (0.54) SLC16A1CYP2C9MAPKAPK2CAMK2BHIPK4
SCHEMBL5394043 0.81 SLC16A1 (0.52) SLC16A1CYP2C9MAPKAPK2CAMK2BHIPK4
SCHEMBL5400397 0.80 SLC16A1 (0.56) SLC16A1CYP2C9MAPKAPK2CAMK2BHIPK4
SCHEMBL5402601 0.80 SLC16A1 (0.53) SLC16A1CYP2C9MAPKAPK2CAMK2BHIPK4

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
US-7285558-B2 Pyrazolo[3,4-d]pyrimidines inhibiting H. pylori infections ASTRAZENECA AB (SE) 2007-10-23 US disclosed
US-7285558-B2 Pyrazolo[3,4-d]pyrimidines inhibiting H. pylori infections ASTRAZENECA AB (SE) 2007-10-23 US disclosed
US-7285558-B2 Pyrazolo[3,4-d]pyrimidines inhibiting H. pylori infections ASTRAZENECA AB (SE) 2007-10-23 US disclosed