SCHEMBL13919872

SCHEMBL13919872

CCC(=O)N1CC[C@@H](NC(=O)c2nc(-c3ccc(OC)c4nc(C(F)(F)F)ccc34)oc2[C@H](C)N)C1

nearest known ligand 0.62

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
▸ PDE4B Q07343 20/20 0.62
▸ PDE11A Q9HCR9 11/20 0.62
▸ PDE10A Q9Y233 1/20 0.61

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
SCHEMBL13919879 1.00 PDE4B (0.62) PDE4BPDE11APDE10A
SCHEMBL13919777 0.92 PDE4B (0.60) PDE4BPDE11APDE10A
SCHEMBL13919732 0.92 PDE4B (0.60) PDE4BPDE11APDE10A
SCHEMBL13919878 0.92 PDE4B (0.62) PDE4BPDE11APDE10A
SCHEMBL13919868 0.92 PDE4B (0.62) PDE4BPDE11APDE10A
SCHEMBL13919870 0.92 PDE4B (0.62) PDE4BPDE11APDE10A
SCHEMBL13919909 0.92 PDE4B (0.62) PDE4BPDE11APDE10A
SCHEMBL13919839 0.92 PDE4B (0.62) PDE4BPDE11APDE10A
SCHEMBL13919789 0.92 PDE4B (0.62) PDE4BPDE11APDE10A
SCHEMBL13919753 0.92 PDE4B (0.62) 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 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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