SCHEMBL6910944

SCHEMBL6910944

Cc1nc(N)c2nnn(C[C@H]3CNCCO3)c2n1

nearest known ligand 0.68

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
PDE8B O95263 20/20 0.68
PDE8A O60658 2/20 0.52

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
SCHEMBL6910546 1.00 PDE8B (0.68) PDE8BPDE8A
SCHEMBL6910407 0.84 PDE8B (0.72) PDE8B
SCHEMBL6909028 0.84 PDE8B (0.72) PDE8B
SCHEMBL6909035 0.83 PDE8B (0.71) PDE8BPDE8A
SCHEMBL6910234 0.79 PDE8B (0.68) PDE8BPDE8A
SCHEMBL6909462 0.71 PDE8B (1.00) PDE8BPDE8A
SCHEMBL6910946 0.71 PDE8B (1.00) PDE8BPDE8A
SCHEMBL6910646 0.71 PDE8B (0.69) PDE8BPDE8A
SCHEMBL6909572 0.69 PDE8B (1.00) PDE8BPDE8A
SCHEMBL30979663 0.64 MET (0.52)

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
WO-2011058478-A1 SUBSTITUTED TRIAZOLOPYRIMIDINES AS PDE8 INHIBITORS PFIZER INC. (US) 2011-05-19 WO disclosed