SCHEMBL8008747

SCHEMBL8008747

Bc1cc(CNC(=O)NCc2c(CC)nc3c(cnn3CC)c2NC2CCOCC2)ccc1F

nearest known ligand 0.49

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
PDE4B Q07343 17/20 0.49
MAPK1 P28482 3/20 0.39
RPS6KA1 Q15418 1/20 0.39
PDE7A Q13946 1/20 0.36

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
SCHEMBL13760886 0.96 PDE4B (0.49) PDE4BMAPK1RPS6KA1
SCHEMBL13761163 0.95 PDE4B (0.48) PDE4BMAPK1RPS6KA1PDE7A
SCHEMBL13761187 0.94 PDE4B (0.48) PDE4BMAPK1RPS6KA1
SCHEMBL13760224 0.93 PDE4B (0.47) PDE4BMAPK1RPS6KA1
SCHEMBL8014784 0.92 PDE4B (0.50) PDE4BPDE7A
SCHEMBL8018157 0.92 PDE4B (0.50) PDE4BMAPK1RPS6KA1PDE7A
SCHEMBL8016371 0.92 PDE4B (0.51) PDE4BMAPK1RPS6KA1
SCHEMBL13760978 0.92 PDE4B (0.51) PDE4BMAPK1RPS6KA1
SCHEMBL7999785 0.91 PDE4B (0.49) PDE4BMAPK1RPS6KA1PDE7A
SCHEMBL13760925 0.91 PDE4B (0.49) PDE4BMAPK1RPS6KA1

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-2009100170-A1 DUAL PHARMACOPHORES - PDE4-MUSCARINIC ANTAGONISTICS GLAXO GROUP LIMITED (GB) 2009-08-13 WO disclosed