SCHEMBL13920359

SCHEMBL13920359

CC[C@H](N)c1oc(-c2ccc(OC)c3nc(C(F)(F)F)ccc23)nc1C(=O)N1CCC(O)(c2ncccn2)CC1

nearest known ligand 0.65

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
▸ PDE4B Q07343 20/20 0.65
▸ PDE11A Q9HCR9 13/20 0.65
▸ PDE10A Q9Y233 10/20 0.65

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
SCHEMBL8272960 0.92 PDE4B (0.65) PDE4BPDE11APDE10A
SCHEMBL13920357 0.89 PDE4B (0.60) PDE4BPDE11APDE10A
SCHEMBL13920392 0.88 PDE4B (0.78) PDE4BPDE11APDE10A
SCHEMBL13920367 0.88 PDE4B (0.75) PDE4BPDE11APDE10A
SCHEMBL13920369 0.88 PDE4B (0.75) PDE4BPDE11APDE10A
SCHEMBL13920361 0.87 PDE4B (0.61) PDE4BPDE11APDE10A
SCHEMBL13919253 0.86 PDE4B (0.61) PDE4BPDE11APDE10A
SCHEMBL8275331 0.85 PDE4B (0.65) PDE4BPDE11APDE10A
SCHEMBL13920363 0.85 PDE4B (0.55) PDE4BPDE11APDE10A
SCHEMBL13919241 0.85 PDE4B (0.60) 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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