SCHEMBL7329994

SCHEMBL7329994

CCC(=O)Cc1ccc(OC)c(OC2CCCC2)c1

nearest known ligand 0.55

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
POLB P06746 1/20 0.55
PDE4B Q07343 13/20 0.54
PDE4A P27815 10/20 0.54
PDE4D Q08499 10/20 0.54
PDE4C Q08493 9/20 0.54
MAPK14 Q16539 1/20 0.50
RECQL P46063 1/20 0.50

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
SCHEMBL7332241 0.87 PDE4A (0.57) PDE4BPDE4APDE4DPDE4C
SCHEMBL2371289 0.86 PDE4B (0.60) POLBPDE4BPDE4APDE4DPDE4C
SCHEMBL7332617 0.85 PDE4B (0.58) POLBPDE4BPDE4APDE4DPDE4C
SCHEMBL7023339 0.85 PDE4B (0.55) POLBPDE4BPDE4APDE4DPDE4C
SCHEMBL7364116 0.85 PDE4B (0.56) POLBPDE4BPDE4APDE4DPDE4C
SCHEMBL7340266 0.83 PDE4B (0.53) POLBPDE4BPDE4APDE4DPDE4C
SCHEMBL8373034 0.83 LMNA (0.58)
SCHEMBL31618757 0.83 LMNA (0.58)
SCHEMBL7331685 0.82 PDE4A (0.49) POLBPDE4BPDE4APDE4DPDE4C
SCHEMBL7331695 0.82 PDE4A (0.49) POLBPDE4BPDE4APDE4DPDE4C

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-0470805-A1 Oxime-carbamates and oxime-carbonates as bronchodilators and anti-inflammatory agents AMERICAN HOME PRODUCTS CORPORATION (US) 1992-02-12 EP claimed