SCHEMBL13919103

SCHEMBL13919103

COC[C@@H]1CC[C@@H](COC)N1C(=O)c1nc(-c2ccc(OC)c3nc(C(F)(F)F)ccc23)oc1[C@H](C)N

nearest known ligand 0.60

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
▸ PDE4B Q07343 20/20 0.60
▸ PDE11A Q9HCR9 11/20 0.60
▸ PDE10A Q9Y233 1/20 0.55

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
SCHEMBL13918983 0.90 PDE4B (0.59) PDE4BPDE11APDE10A
SCHEMBL13918982 0.90 PDE4B (0.59) PDE4BPDE11APDE10A
SCHEMBL13919967 0.89 PDE4B (0.61) PDE4BPDE11APDE10A
SCHEMBL13919962 0.89 PDE4B (0.61) PDE4BPDE11APDE10A
SCHEMBL13919131 0.88 PDE4B (0.57) PDE4BPDE11APDE10A
SCHEMBL13918822 0.86 PDE4B (0.58) PDE4BPDE11APDE10A
SCHEMBL13918833 0.86 PDE4B (0.58) PDE4BPDE11APDE10A
SCHEMBL8272996 0.84 PDE4B (0.59) PDE4BPDE11APDE10A
SCHEMBL8272920 0.84 PDE4B (0.59) PDE4BPDE11APDE10A
SCHEMBL13920192 0.84 PDE4B (0.59) 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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