SCHEMBL4946724

SCHEMBL4946724

Cc1cc(S(=O)(=O)C2CCN(C(=O)C3CC3)CC2)c2ncc(C(N)=O)c(Nc3cccc4c3CCO4)c2c1

nearest known ligand 0.56

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
PDE4B Q07343 8/20 0.56
CSF1R P07333 5/20 0.35
KCNH2 Q12809 1/20 0.34
CYP3A4 P08684 2/20 0.34
CYP2C9 P11712 2/20 0.34
GCK P35557 1/20 0.34
MTNR1B P49286 1/20 0.33
SYK P43405 1/20 0.33

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
SCHEMBL1275608 0.89 PDE4B (0.59) PDE4BCSF1RKCNH2CYP3A4CYP2C9
SCHEMBL4949429 0.89 PDE4B (0.50) PDE4BCYP3A4CYP2C9
SCHEMBL4949101 0.85 PDE4B (0.68) PDE4BCSF1RMTNR1B
SCHEMBL4628322 0.83 PDE4B (0.57) PDE4BCSF1RKCNH2CYP3A4CYP2C9
SCHEMBL8312156 0.83 PDE4B (0.57) PDE4BCSF1RMTNR1B
SCHEMBL4625986 0.83 PDE4B (0.55) PDE4BCSF1RMTNR1BSYK
Hydrochloric Acid SCHEMBL4264207 0.82 PDE4B (0.57) PDE4BCSF1RMTNR1B
SCHEMBL4949711 0.82 PDE4B (0.64) PDE4BCSF1RMTNR1B
SCHEMBL8313135 0.81 PDE4B (0.59) PDE4BCSF1RKCNH2
SCHEMBL8308172 0.81 PDE4B (0.57) PDE4BCSF1RKCNH2CYP3A4CYP2C9

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