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SCHEMBL13918679

SCHEMBL13918679

COc1ccc(-c2nc(C(=O)N[C@H](CO)C(C)C)c(CN)o2)c2ccc(C(F)(F)F)nc12

nearest known ligand 0.76

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
▸ PDE4B Q07343 20/20 0.76
▸ PDE11A Q9HCR9 11/20 0.71
▸ PDE10A Q9Y233 1/20 0.71
▸ 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
SCHEMBL13918540 1.00 PDE4B (0.76) PDE4BPDE11APDE10APDE4D
SCHEMBL8273009 0.91 PDE4B (0.79) PDE4BPDE11APDE10APDE4D
SCHEMBL13918676 0.90 PDE4B (0.76) PDE4BPDE11APDE10APDE4D
SCHEMBL8275019 0.90 PDE4B (0.78) PDE4BPDE11APDE10APDE4D
SCHEMBL13919673 0.89 PDE4B (0.78) PDE4BPDE11APDE10A
SCHEMBL8274573 0.89 PDE4B (0.75) PDE4BPDE11APDE10APDE4D
SCHEMBL13918624 0.89 PDE4B (0.82) PDE4BPDE11APDE10APDE4D
SCHEMBL13918612 0.89 PDE4B (0.82) PDE4BPDE11APDE10APDE4D
SCHEMBL13918611 0.89 PDE4B (0.82) PDE4BPDE11APDE10APDE4D
SCHEMBL8275079 0.88 PDE4B (0.78) 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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