SCHEMBL8366291

SCHEMBL8366291

CCCCCOC(=O)C=C(C#N)c1ccc(OC)c(OC)c1

nearest known ligand 0.52

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
SMPD1 P17405 4/20 0.48
PDE4B Q07343 3/20 0.46
PDE4A P27815 2/20 0.45
PDE4C Q08493 2/20 0.45
PDE4D Q08499 2/20 0.45
MEN1 O00255 2/20 0.45
KMT2A Q03164 2/20 0.45
MAPT P10636 2/20 0.45
THRA P10827 1/20 0.45
THRB P10828 1/20 0.45
GAA P10253 1/20 0.45
HTT P42858 1/20 0.45
HDAC3 O15379 1/20 0.44
HDAC2 Q92769 1/20 0.44
PLA2G4B P0C869 1/20 0.44
ALDH1A1 P00352 2/20 0.44
HPGD P15428 1/20 0.44
CA12 O43570 1/20 0.43
CA1 P00915 1/20 0.43
CA2 P00918 1/20 0.43

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
SCHEMBL8362145 0.99 SMPD1 (0.50) SMPD1PDE4BPDE4APDE4CPDE4D
SCHEMBL8649290 0.99 SMPD1 (0.50) SMPD1PDE4BPDE4APDE4CPDE4D
SCHEMBL8362314 0.99 SMPD1 (0.50) SMPD1PDE4BPDE4APDE4CPDE4D
SCHEMBL8359737 0.99 SMPD1 (0.50) SMPD1PDE4BPDE4APDE4CPDE4D
SCHEMBL8365965 0.99 SMPD1 (0.50) SMPD1PDE4BPDE4APDE4CPDE4D
SCHEMBL8359713 0.99 SMPD1 (0.50) SMPD1PDE4BPDE4APDE4CPDE4D
SCHEMBL8366505 0.96 MEN1 (0.48) SMPD1PDE4BPDE4APDE4CPDE4D
SCHEMBL8361911 0.92 PDE4B (0.49) PDE4BPDE4APDE4CPDE4DMAPT
SCHEMBL8024614 0.87 PDE4B (0.43) PDE4BPDE4APDE4CPDE4DMEN1
SCHEMBL8364475 0.87 PDE4B (0.54) PDE4BPDE4APDE4CPDE4DMEN1

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
WO-1999036049-A1 PHOTOSTABLE UV ABSORBENT CONTAINING α-CYANO CINNAMYL MOIETY ISP INVESTMENTS INC. (US) 1999-07-22 WO disclosed