SCHEMBL8274548

SCHEMBL8274548

CCOC(=O)[C@@H]1CCCN1C(=O)c1nc(-c2ccc(OC)c3nc(C(F)(F)F)ccc23)oc1[C@H](C)N

nearest known ligand 0.57

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
PDE4B Q07343 20/20 0.57
PDE11A Q9HCR9 11/20 0.56
PDE10A Q9Y233 1/20 0.51

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
SCHEMBL13919033 1.00 PDE4B (0.57) PDE4BPDE11APDE10A
SCHEMBL8275081 0.92 PDE4B (0.56) PDE4BPDE11APDE10A
SCHEMBL12162823 0.90 PDE4B (0.54) PDE4BPDE11APDE10A
SCHEMBL8275037 0.89 PDE4B (0.70) PDE4BPDE11APDE10A
SCHEMBL13919129 0.88 PDE4B (0.56) PDE4BPDE11APDE10A
SCHEMBL12464597 0.88 PDE4B (0.56) PDE4BPDE11APDE10A
SCHEMBL13918941 0.88 PDE4B (0.55) PDE4BPDE11APDE10A
SCHEMBL13919132 0.88 PDE4B (0.56) PDE4BPDE11APDE10A
SCHEMBL13933975 0.88 PDE4B (0.55) PDE4BPDE11APDE10A
SCHEMBL13919146 0.88 PDE4B (0.56) PDE4BPDE11APDE10A

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 3 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7511062-B2 Substituted 2-quinolyl-oxazoles useful as PDE4 inhibitors SCHERING CORPORATION (US) 2009-03-31 US disclosed
US-7511062-B2 Substituted 2-quinolyl-oxazoles useful as PDE4 inhibitors SCHERING CORPORATION (US) 2009-03-31 US disclosed
WO-2005116009-A1 SUBSTITUTED 2-QUINOLYL-OXAZOLES USEFUL AS PDE4 INHIBITORS SCHERING CORPORATION (US) 2005-12-08 WO disclosed