SCHEMBL7361049

SCHEMBL7361049

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

nearest known ligand 0.53

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
PDE4A P27815 14/20 0.53
PDE4B Q07343 9/20 0.53
PDE4D Q08499 8/20 0.53
PDE4C Q08493 7/20 0.53
POLB P06746 1/20 0.51
MAPK14 Q16539 1/20 0.49

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
SCHEMBL7357352 0.91 PDE4B (0.53) PDE4APDE4BPDE4DPDE4CPOLB
SCHEMBL7359135 0.90 PDE4A (0.55) PDE4APDE4BPDE4DPDE4CPOLB
SCHEMBL9287915 0.89 PDE4A (0.53) PDE4APDE4BPDE4DPDE4CPOLB
SCHEMBL27537534 0.89 PDE4A (0.56) PDE4APDE4BPDE4DPDE4CMAPK14
SCHEMBL7395197 0.87 PDE4A (0.52) PDE4APDE4BPDE4DPDE4CPOLB
SCHEMBL8573504 0.85 PDE4A (0.58) PDE4APDE4BPDE4DPDE4CPOLB
SCHEMBL11001026 0.85 ALDH1A1 (0.52) PDE4APDE4BPDE4DPDE4C
SCHEMBL7099179 0.83 PDE4B (0.53) PDE4APDE4BPDE4DPDE4CPOLB
SCHEMBL7363845 0.81 PDE4A (0.61) PDE4APDE4BPDE4DPDE4CPOLB
SCHEMBL7913418 0.81 PDE4A (0.59) PDE4APDE4BPDE4DPDE4C

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