SCHEMBL8272923

SCHEMBL8272923

CC[C@@H](CNc1ncccn1)NC(=O)c1nc(-c2ccc(OC)c3nc(C(F)(F)F)ccc23)oc1CN

nearest known ligand 0.67

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
▸ PDE4B Q07343 20/20 0.67
▸ PDE11A Q9HCR9 15/20 0.63
▸ PDE10A Q9Y233 3/20 0.63
▸ PDE4D Q08499 1/20 0.58

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
SCHEMBL13918769 0.91 PDE4B (0.69) PDE4BPDE11APDE10APDE4D
SCHEMBL13919553 0.90 PDE4B (0.67) PDE4BPDE11APDE10A
SCHEMBL8272933 0.88 PDE4B (0.68) PDE4BPDE11APDE10APDE4D
SCHEMBL12162578 0.86 PDE4B (0.72) PDE4BPDE11APDE10APDE4D
SCHEMBL8275079 0.85 PDE4B (0.78) PDE4BPDE11APDE10APDE4D
SCHEMBL12163088 0.84 PDE4B (0.70) PDE4BPDE11APDE10APDE4D
SCHEMBL13918767 0.84 PDE4B (0.70) PDE4BPDE11APDE10APDE4D
SCHEMBL13918772 0.84 PDE4B (0.70) PDE4BPDE11APDE10APDE4D
SCHEMBL13918410 0.83 PDE4B (0.88) PDE4BPDE11APDE10A
SCHEMBL13918444 0.83 PDE4B (0.88) 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 4 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1758883-B1 Substituted 2-quinolyl-oxazoles useful as PDE4 inhibitors SCHERING CORP (US) 2011-11-02 — — EP disclosed
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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