SCHEMBL8274615

SCHEMBL8274615

COc1ccc(-c2nc(C(=O)N3CCC(C(=O)c4ccc(C)cc4)CC3)c([C@H](C)N)o2)c2ccc(C(F)(F)F)nc12

nearest known ligand 0.59

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
▸ PDE4B Q07343 20/20 0.59
▸ PDE11A Q9HCR9 14/20 0.56
▸ PDE10A Q9Y233 6/20 0.54

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
SCHEMBL13919115 0.94 PDE4B (0.59) PDE4BPDE11APDE10A
SCHEMBL8274590 0.90 PDE4B (0.62) PDE4BPDE11APDE10A
SCHEMBL8274593 0.90 PDE4B (0.58) PDE4BPDE11APDE10A
SCHEMBL13919325 0.87 PDE4B (0.62) PDE4BPDE11APDE10A
SCHEMBL8274585 0.87 PDE4B (0.70) PDE4BPDE11APDE10A
SCHEMBL13919328 0.87 PDE4B (0.64) PDE4BPDE11APDE10A
SCHEMBL13920040 0.86 PDE4B (0.76) PDE4BPDE11APDE10A
SCHEMBL13919801 0.86 PDE4B (0.77) PDE4BPDE11APDE10A
SCHEMBL13919955 0.86 PDE4B (0.77) PDE4BPDE11APDE10A
SCHEMBL8272917 0.86 PDE4B (0.77) 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 1 patent. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2005116009-A1 SUBSTITUTED 2-QUINOLYL-OXAZOLES USEFUL AS PDE4 INHIBITORS SCHERING CORPORATION (US) 2005-12-08 — — WO disclosed
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