SCHEMBL7357352

SCHEMBL7357352

CCOC(=O)C(CN)c1ccc(OC)c(OC2CCCC2)c1

nearest known ligand 0.53

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
PDE4B Q07343 11/20 0.53
PDE4A P27815 15/20 0.52
PDE4D Q08499 9/20 0.52
PDE4C Q08493 8/20 0.52
MAPK14 Q16539 1/20 0.47
POLB P06746 1/20 0.46

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
SCHEMBL7361049 0.91 PDE4A (0.53) PDE4BPDE4APDE4DPDE4CMAPK14
SCHEMBL7359135 0.88 PDE4A (0.55) PDE4BPDE4APDE4DPDE4CMAPK14
SCHEMBL27537534 0.87 PDE4A (0.56) PDE4BPDE4APDE4DPDE4CMAPK14
SCHEMBL9283831 0.87 PDE4B (0.53) PDE4BPDE4APDE4DPDE4CPOLB
SCHEMBL5743088 0.85 CA12 (0.52) POLB
Hydrochloric Acid SCHEMBL5743084 0.84 CA12 (0.51) POLB
SCHEMBL7326043 0.83 PDE4B (0.49) PDE4BPDE4APDE4DPDE4CPOLB
SCHEMBL7320061 0.81 PDE4A (0.48) PDE4BPDE4APDE4DPDE4CPOLB
SCHEMBL9287915 0.80 PDE4A (0.53) PDE4BPDE4APDE4DPDE4CPOLB
SCHEMBL7913418 0.79 PDE4A (0.59) PDE4BPDE4APDE4DPDE4C

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 4 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0538384-A4 OXAMIDES SMITHKLINE BEECHAM CORP (US) 1995-04-12 EP disclosed
US-5393788-A Phenylalkyl oxamides SMITHKLINE BEECHAM CORPORATION (US) 1995-02-28 US disclosed
EP-0538384-A1 OXAMIDES SMITHKLINE BEECHAM CORPORATION (US) 1993-04-28 EP disclosed
WO-1992000968-A1 OXAMIDES SMITHKLINE BEECHAM CORPORATION (US) 1992-01-23 WO disclosed