SCHEMBL8275274

SCHEMBL8275274

COC(=O)c1nc(-c2ccc(OC)c3nc(C(F)(F)F)ccc23)sc1C

nearest known ligand 0.57

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
▸ PDE4B Q07343 20/20 0.57
▸ PDE11A Q9HCR9 2/20 0.52
▸ PDE10A Q9Y233 1/20 0.52
▸ PDE4A P27815 2/20 0.49
▸ PDE4C Q08493 2/20 0.49
▸ PDE4D Q08499 2/20 0.49
▸ PDE3A Q14432 1/20 0.48

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
SCHEMBL8275269 0.86 PDE4B (0.51) PDE4BPDE11APDE10APDE3A
SCHEMBL8275376 0.82 PDE4B (0.51) PDE4BPDE11APDE10APDE4APDE4C
SCHEMBL8275375 0.80 PDE4B (0.47) PDE4BPDE11APDE10APDE4APDE4C
SCHEMBL8275273 0.80 PDE4B (0.46) PDE4BPDE11APDE10APDE3A
SCHEMBL13920549 0.80 PDE4B (0.66) PDE4BPDE11APDE10A
SCHEMBL8274722 0.80 PDE4B (0.52) PDE4BPDE11APDE10APDE3A
SCHEMBL13920546 0.80 PDE4B (0.58) PDE4BPDE11APDE10A
SCHEMBL8274034 0.79 PDE4B (0.84) PDE4BPDE11APDE10A
SCHEMBL5207914 0.77 PDE4B (0.65) PDE4BPDE11APDE10APDE4APDE4C
SCHEMBL8274724 0.77 PDE4B (0.52) PDE4BPDE11APDE10APDE4APDE4C

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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