SCHEMBL12162929

SCHEMBL12162929

COc1ccc(-c2nc(C(=O)NCC(=O)NCC(=O)O)c([C@H](C)N)o2)c2ccc(C(F)(F)F)nc12

nearest known ligand 0.72

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
▸ PDE4B Q07343 20/20 0.72
▸ PDE11A Q9HCR9 11/20 0.72

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
SCHEMBL13920197 0.92 PDE4B (0.71) PDE4BPDE11A
SCHEMBL13920026 0.91 PDE4B (0.79) PDE4BPDE11A
SCHEMBL13920254 0.90 PDE4B (0.73) PDE4BPDE11A
SCHEMBL13920203 0.89 PDE4B (0.68) PDE4BPDE11A
SCHEMBL8272918 0.89 PDE4B (0.78) PDE4BPDE11A
SCHEMBL13919816 0.89 PDE4B (0.78) PDE4BPDE11A
SCHEMBL13919826 0.89 PDE4B (0.69) PDE4BPDE11A
SCHEMBL13919833 0.88 PDE4B (0.75) PDE4BPDE11A
SCHEMBL13919414 0.88 PDE4B (0.73) PDE4BPDE11A
SCHEMBL13919807 0.88 PDE4B (0.90) PDE4BPDE11A

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
EP-1758883-B1 Substituted 2-quinolyl-oxazoles useful as PDE4 inhibitors SCHERING CORP (US) 2011-11-02 — — EP disclosed
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