SCHEMBL8103487

SCHEMBL8103487

CCOC(=[SiH2])[C@@H]1CCCN1C(=O)c1nc(-c2ccc(OC)c3nc(C(F)(F)F)ccc23)oc1CN

nearest known ligand 0.68

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
PDE4B Q07343 20/20 0.68
PDE11A Q9HCR9 14/20 0.61
PDE10A Q9Y233 10/20 0.61

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
SCHEMBL8275037 0.93 PDE4B (0.70) PDE4BPDE11APDE10A
SCHEMBL8274062 0.87 PDE4B (0.71) PDE4BPDE11APDE10A
SCHEMBL12162869 0.85 PDE4B (0.74) PDE4BPDE11APDE10A
SCHEMBL8274063 0.85 PDE4B (0.73) PDE4BPDE11APDE10A
SCHEMBL12162564 0.84 PDE4B (0.64) PDE4BPDE11APDE10A
SCHEMBL8274548 0.82 PDE4B (0.57) PDE4BPDE11APDE10A
SCHEMBL13919033 0.82 PDE4B (0.57) PDE4BPDE11APDE10A
SCHEMBL8276380 0.82 PDE4B (0.62) PDE4BPDE11APDE10A
SCHEMBL8276457 0.82 PDE4B (1.00) PDE4BPDE11APDE10A
SCHEMBL8274575 0.82 PDE4B (1.00) 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-2009009003-A1 PROCESS FOR THE PRODUCTION OF SUBSTITUTED 5-QUINOLYL-OXAZOLES AND PHARMACEUTICALLY ACCEPTABLE SALTS THEREOF SCHERING CORPORATION (US) 2009-01-15 WO disclosed