SCHEMBL7465058

SCHEMBL7465058

COC(=O)C(=C\c1ccc(OC2CCCC2)c(OC)c1)/C(=C\c1ccccc1)C(=O)NCc1ccncc1

nearest known ligand 0.49

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
PDE4A P27815 16/20 0.48
PDE4D Q08499 3/20 0.44
PDE4B Q07343 3/20 0.44
PDE4C Q08493 2/20 0.44

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
SCHEMBL7465061 1.00 PDE4A (0.48) PDE4APDE4DPDE4BPDE4C
Hydrochloric Acid SCHEMBL7459498 0.99 PDE4A (0.47) PDE4APDE4DPDE4BPDE4C
Hydrochloric Acid SCHEMBL7378460 0.99 PDE4A (0.47) PDE4APDE4DPDE4BPDE4C
SCHEMBL6761073 0.83 LMNA (0.48)
SCHEMBL6761071 0.83 LMNA (0.48)
SCHEMBL7384149 0.83 PDE4B (0.47) PDE4APDE4DPDE4BPDE4C
SCHEMBL7384154 0.83 PDE4B (0.47) PDE4APDE4DPDE4BPDE4C
Hydrochloric Acid SCHEMBL7972152 0.82 PDE4A (0.42) PDE4APDE4DPDE4BPDE4C
SCHEMBL7465642 0.81 PDE4B (0.47) PDE4APDE4DPDE4BPDE4C
SCHEMBL7465654 0.81 PDE4B (0.47) PDE4APDE4DPDE4BPDE4C

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
EP-0889879-B1 BUTADIENE DERIVATIVES AND PROCESS FOR PREPARING THEREOF TANABE SEIYAKU CO (JP) 2002-06-12 EP disclosed
US-6248743-B1 ANTITHROMBOTIC AGENTS EFFECTIVE TO INHIBIT THE PRODUCTION OF TYPE 1 PLASMINOGEN ACTIVATOR INHIBITOR (PAI-1) TANABE SEIYAKU CO., LTD. (JP) 2001-06-19 US disclosed