SCHEMBL4944342

SCHEMBL4944342

COc1cc(Nc2c(C(N)=O)cnc3c(S(=O)(=O)c4ccccc4)cccc23)ccc1O

nearest known ligand 0.57

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
PDE4B Q07343 13/20 0.57
CSF1R P07333 3/20 0.47
MAPT P10636 1/20 0.47
EGFR P00533 1/20 0.47
ERBB2 P04626 1/20 0.47
MAPK8 P45983 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
SCHEMBL4947650 0.86 PDE4B (0.75) PDE4B
SCHEMBL1276452 0.83 PDE4B (0.75) PDE4B
SCHEMBL4949247 0.82 PDE4B (0.56) PDE4BCSF1R
SCHEMBL4952401 0.81 PDE4B (0.75) PDE4BCSF1R
SCHEMBL4946533 0.81 PDE4B (0.64) PDE4BCSF1REGFRERBB2
SCHEMBL4952559 0.80 PDE4B (0.67) PDE4BCSF1R
SCHEMBL4948833 0.79 PDE4B (0.52) PDE4BCSF1R
SCHEMBL4946564 0.79 PDE4B (0.49) PDE4BCSF1R
SCHEMBL4949272 0.79 PDE4B (0.71) PDE4BCSF1R
SCHEMBL4950158 0.79 PDE4B (0.73) PDE4BCSF1REGFRERBB2

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