SCHEMBL13920550

SCHEMBL13920550

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

nearest known ligand 0.75

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
▸ PDE4B Q07343 20/20 0.75
▸ PDE11A Q9HCR9 10/20 0.75
▸ PDE10A Q9Y233 1/20 0.75
▸ PDE4D Q08499 1/20 0.64

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
SCHEMBL8272980 0.85 PDE4B (1.00) PDE4BPDE11APDE10A
SCHEMBL13920555 0.84 PDE4B (0.91) PDE4BPDE11APDE4D
SCHEMBL8275243 0.83 PDE4B (0.83) PDE4BPDE11APDE10A
SCHEMBL8209705 0.83 PDE4B (0.81) PDE4BPDE11APDE10A
SCHEMBL8275050 0.83 PDE4B (1.00) PDE4BPDE11APDE10APDE4D
SCHEMBL8274272 0.83 PDE4B (0.81) PDE4BPDE11APDE4D
SCHEMBL13920610 0.82 PDE4B (0.70) PDE4BPDE11APDE10A
SCHEMBL12162827 0.82 PDE4B (0.82) PDE4BPDE11APDE10A
SCHEMBL8274277 0.81 PDE4B (0.60) PDE4BPDE11APDE10A
SCHEMBL12162861 0.81 PDE4B (0.83) PDE4BPDE11APDE10APDE4D

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 2 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
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