SCHEMBL13919116

SCHEMBL13919116

COc1ccnc(OC2CCN(C(=O)c3nc(-c4ccc(OC)c5nc(C(F)(F)F)ccc45)oc3[C@H](C)N)CC2)n1

nearest known ligand 0.56

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
▸ PDE4B Q07343 20/20 0.56
▸ PDE11A Q9HCR9 15/20 0.54
▸ PDE10A Q9Y233 8/20 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
SCHEMBL8272959 0.93 PDE4B (0.60) PDE4BPDE11APDE10A
SCHEMBL8276367 0.89 PDE4B (0.71) PDE4BPDE11APDE10A
SCHEMBL13919106 0.88 PDE4B (0.60) PDE4BPDE11APDE10A
SCHEMBL13919109 0.87 PDE4B (0.56) PDE4BPDE11APDE10A
SCHEMBL8275188 0.86 PDE4B (0.68) PDE4BPDE11APDE10A
SCHEMBL13919070 0.86 PDE4B (0.58) PDE4BPDE11APDE10A
SCHEMBL13919122 0.85 PDE4B (0.61) PDE4BPDE11APDE10A
SCHEMBL13919254 0.85 PDE4B (0.61) PDE4BPDE11APDE10A
SCHEMBL13919955 0.84 PDE4B (0.77) PDE4BPDE11APDE10A
SCHEMBL13920040 0.84 PDE4B (0.76) 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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