SCHEMBL16350362

SCHEMBL16350362

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

nearest known ligand 0.44

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
▸ PDE4B Q07343 20/20 0.44
▸ PDE11A Q9HCR9 5/20 0.42
▸ PDE10A Q9Y233 1/20 0.42
▸ PDE3A Q14432 2/20 0.41
▸ PDE4A P27815 3/20 0.40
▸ PDE4C Q08493 3/20 0.40
▸ PDE4D Q08499 3/20 0.40

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
SCHEMBL16350363 0.92 PDE4B (0.49) PDE4BPDE11APDE10APDE3APDE4A
SCHEMBL13920536 0.91 PDE4B (0.42) PDE4BPDE11APDE10APDE3APDE4A
SCHEMBL13920538 0.87 PDE4B (0.43) PDE4BPDE11APDE10APDE3APDE4A
SCHEMBL8275375 0.87 PDE4B (0.47) PDE4BPDE11APDE10APDE3APDE4A
SCHEMBL13920537 0.83 PDE4B (0.47) PDE4BPDE11APDE10APDE3APDE4A
SCHEMBL16350365 0.81 PDE4B (0.56) PDE4BPDE11APDE10A
SCHEMBL8275376 0.79 PDE4B (0.51) PDE4BPDE11APDE10APDE3APDE4A
SCHEMBL13920535 0.78 PDE4B (0.49) PDE4BPDE11APDE10A
SCHEMBL13920541 0.78 PDE4B (0.54) PDE4BPDE11APDE10APDE3A
SCHEMBL8275274 0.77 PDE4B (0.57) PDE4BPDE11APDE10APDE3APDE4A

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 1 patent. 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
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