SCHEMBL4948833

SCHEMBL4948833

Cn1cnc2ccc(Nc3c(C(N)=O)cnc4c(S(=O)(=O)c5ccccc5)cccc34)cc21

nearest known ligand 0.52

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
PDE4B Q07343 18/20 0.52
CSF1R P07333 1/20 0.43
LRRK2 Q5S007 1/20 0.43

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
SCHEMBL1276426 0.85 PDE4B (0.72) PDE4B
SCHEMBL4946564 0.85 PDE4B (0.49) PDE4BCSF1RLRRK2
SCHEMBL4946647 0.81 PDE4B (0.73) PDE4B
SCHEMBL4948734 0.81 PDE4B (0.54) PDE4B
SCHEMBL4949247 0.81 PDE4B (0.56) PDE4BCSF1RLRRK2
SCHEMBL4947650 0.80 PDE4B (0.75) PDE4B
SCHEMBL4944342 0.79 PDE4B (0.57) PDE4BCSF1R
SCHEMBL4949272 0.78 PDE4B (0.71) PDE4BCSF1RLRRK2
SCHEMBL2478457 0.77 PDE4B (0.58) PDE4B
SCHEMBL4950488 0.75 PDE4B (0.50) PDE4BCSF1RLRRK2

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-1633748-B1 QUINOLINE DERIVATIVES AS PHOSPHODIESTERASE INHIBITORS GLAXO GROUP LTD (GB) 2008-03-05 EP claimed