SCHEMBL8274272

SCHEMBL8274272

COc1ccc(-c2nc(C(=O)NCc3ccc(F)cc3C)c(CCN)o2)c2ccc(C(F)(F)F)nc12

nearest known ligand 0.81

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
▸ PDE4B Q07343 20/20 0.81
▸ PDE11A Q9HCR9 16/20 0.81
▸ PDE4D Q08499 1/20 0.81

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
SCHEMBL8272889 0.95 PDE4B (0.87) PDE4BPDE11APDE4D
SCHEMBL13920555 0.94 PDE4B (0.91) PDE4BPDE11APDE4D
SCHEMBL8275298 0.90 PDE4B (1.00) PDE4BPDE11APDE4D
SCHEMBL8272891 0.87 PDE4B (0.87) PDE4BPDE11APDE4D
SCHEMBL13918420 0.85 PDE4B (0.78) PDE4BPDE11APDE4D
SCHEMBL8275063 0.85 PDE4B (0.88) PDE4BPDE11APDE4D
SCHEMBL13918352 0.84 PDE4B (1.00) PDE4BPDE11APDE4D
SCHEMBL13918509 0.83 PDE4B (0.87) PDE4BPDE11APDE4D
SCHEMBL8275090 0.83 PDE4B (1.00) PDE4BPDE11APDE4D
SCHEMBL8276356 0.83 PDE4B (1.00) PDE4BPDE11APDE4D

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
WO-2005116009-A1 SUBSTITUTED 2-QUINOLYL-OXAZOLES USEFUL AS PDE4 INHIBITORS SCHERING CORPORATION (US) 2005-12-08 — — WO disclosed
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