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SCHEMBL8275107

SCHEMBL8275107

COc1ccc(-c2nc(C(=O)N3CC[C@@H](NC(=O)OC(C)(C)C)C3)c(CN)o2)c2ccc(C(F)(F)F)nc12

nearest known ligand 1.00 ✓ in ChEMBL — recovers established targets

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
▸ PDE4B Q07343 20/20 1.00
▸ PDE11A Q9HCR9 14/20 1.00
▸ PDE10A Q9Y233 11/20 1.00

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
SCHEMBL13918510 0.96 PDE4B (0.92) PDE4BPDE11APDE10A
SCHEMBL13918683 0.94 PDE4B (0.90) PDE4BPDE11APDE10A
SCHEMBL13918651 0.94 PDE4B (0.89) PDE4BPDE11APDE10A
SCHEMBL13918685 0.92 PDE4B (0.85) PDE4BPDE11APDE10A
SCHEMBL13918587 0.92 PDE4B (0.84) PDE4BPDE11APDE10A
SCHEMBL13918677 0.91 PDE4B (0.83) PDE4BPDE11APDE10A
SCHEMBL13918678 0.90 PDE4B (0.82) PDE4BPDE11APDE10A
SCHEMBL8233465 0.90 PDE4B (0.82) PDE4BPDE11APDE10A
SCHEMBL8274572 0.90 PDE4B (0.81) PDE4BPDE11APDE10A
SCHEMBL13918539 0.86 PDE4B (0.79) 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
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