SCHEMBL7372969

SCHEMBL7372969

COCOC(=O)C/C(=C\c1ccc(OC2CCCC2)c(OC)c1)C(=O)O

nearest known ligand 0.48

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
PDE4B Q07343 10/20 0.43
PDE4D Q08499 6/20 0.43
PDE4A P27815 5/20 0.43
PDE4C Q08493 5/20 0.43
ALDH1A1 P00352 1/20 0.43
PDE3A Q14432 1/20 0.43
RECQL P46063 1/20 0.42
HDAC1 Q13547 1/20 0.41
HDAC2 Q92769 1/20 0.41
POLB P06746 1/20 0.41

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
SCHEMBL7372973 1.00 PDE4B (0.43) PDE4BPDE4DPDE4APDE4CALDH1A1
SCHEMBL7379908 1.00 PDE4B (0.43) PDE4BPDE4DPDE4APDE4CALDH1A1
SCHEMBL5362920 0.81 PDE4B (0.56) PDE4BPDE4DPDE4APDE4CPOLB
SCHEMBL5362912 0.81 PDE4B (0.56) PDE4BPDE4DPDE4APDE4CPOLB
SCHEMBL7470157 0.80 PDE4B (0.43) PDE4BPDE4DPDE4APDE4CPDE3A
SCHEMBL7470164 0.80 PDE4B (0.43) PDE4BPDE4DPDE4APDE4CPDE3A
SCHEMBL14591412 0.78 PDE4B (0.52) PDE4BPDE4DPDE4APDE4CPOLB
SCHEMBL5351006 0.76 PDE4B (0.55) PDE4BPDE4DPDE4APDE4CPOLB
SCHEMBL5351001 0.76 PDE4B (0.55) PDE4BPDE4DPDE4APDE4CPOLB
SCHEMBL5350996 0.76 PDE4B (0.55) PDE4BPDE4DPDE4APDE4CPOLB

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-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
EP-0889879-A1 BUTADIENE DERIVATIVES AND PROCESS FOR PREPARING THEREOF TANABE SEIYAKU CO., LTD. (JP) 1999-01-13 EP disclosed
WO-1997036864-A1 BUTADIENE DERIVATIVES AND PROCESS FOR PREPARING THEREOF TANABE SEIYAKU CO., LTD. (JP) 1997-10-09 WO disclosed