SCHEMBL4950089

SCHEMBL4950089

CS(=O)(=O)c1cc(F)cc2c(Nc3cccc4c3CCO4)c(C(N)=O)cnc12

nearest known ligand 0.67

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
PDE4B Q07343 8/20 0.67
JAK2 O60674 1/20 0.41
JAK1 P23458 1/20 0.41
TYK2 P29597 1/20 0.41
JAK3 P52333 1/20 0.41
CSF1R P07333 8/20 0.39
MTNR1B P49286 1/20 0.38

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
SCHEMBL4949101 0.91 PDE4B (0.68) PDE4BCSF1RMTNR1B
SCHEMBL4949456 0.90 PDE4B (0.67) PDE4BCSF1RMTNR1B
SCHEMBL4949173 0.89 PDE4B (0.69) PDE4BJAK2JAK1TYK2JAK3
SCHEMBL4951313 0.88 PDE4B (0.65) PDE4BCSF1RMTNR1B
SCHEMBL1275366 0.86 PDE4B (0.74) PDE4BCSF1R
SCHEMBL4952737 0.86 PDE4B (0.61) PDE4BCSF1R
SCHEMBL8311654 0.84 PDE4B (0.66) PDE4BCSF1RMTNR1B
SCHEMBL1275589 0.84 PDE4B (0.75) PDE4BCSF1R
Hydrochloric Acid SCHEMBL2480331 0.84 PDE4B (0.65) PDE4BCSF1RMTNR1B
SCHEMBL4306760 0.83 PDE4B (0.67) PDE4BCSF1RMTNR1B

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