SCHEMBL582885

SCHEMBL582885

CCn1ncc2c(NC3CCOCC3)c(C3=NOC4(CCC(OC(=O)O)CC4)C3)cnc21

nearest known ligand 0.53

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
PDE4B Q07343 19/20 0.53
PDE3B Q13370 1/20 0.46
PDE7A Q13946 1/20 0.46
PDE3A Q14432 1/20 0.46

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
SCHEMBL582909 0.93 PDE4B (0.51) PDE4BPDE7A
SCHEMBL583195 0.93 PDE4B (0.54) PDE4BPDE3BPDE7APDE3A
SCHEMBL583203 0.92 PDE4B (0.44) PDE4BPDE3BPDE7APDE3A
SCHEMBL583732 0.91 PDE4B (0.43) PDE4BPDE3BPDE7APDE3A
SCHEMBL582205 0.90 PDE4B (0.56) PDE4BPDE3BPDE7APDE3A
SCHEMBL582726 0.90 PDE4B (0.51) PDE4BPDE3BPDE7APDE3A
SCHEMBL582753 0.89 PDE4B (0.52) PDE4BPDE3BPDE7APDE3A
SCHEMBL582291 0.88 PDE4B (0.54) PDE4BPDE3BPDE7APDE3A
SCHEMBL583108 0.88 PDE4B (0.54) PDE4BPDE3BPDE7APDE3A
SCHEMBL582452 0.88 PDE4B (0.59) PDE4BPDE3BPDE7APDE3A

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-2124944-B1 Pyrazolo[3,4-b]pyridine derivatives as phosphodiesterase inhibitors RANBAXY LAB LTD (IN) 2012-02-15 EP claimed