SCHEMBL7913434

SCHEMBL7913434

CCCCOc1cc(C2CNC(=O)CO2)ccc1OC

nearest known ligand 0.67

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
PDE4A P27815 18/20 0.67
PDE4D Q08499 13/20 0.67
PDE4B Q07343 12/20 0.67
PDE4C Q08493 11/20 0.67
MAPK1 P28482 2/20 0.50
TNF P01375 1/20 0.50
LMNA P02545 1/20 0.50
MAPT P10636 1/20 0.50
PDE3B Q13370 1/20 0.50
PDE3A Q14432 1/20 0.50
KDM4E B2RXH2 1/20 0.50
MEN1 O00255 1/20 0.50
CYP1A2 P05177 1/20 0.50
CYP3A4 P08684 1/20 0.50
NFKB1 P19838 1/20 0.50
KMT2A Q03164 1/20 0.50
MAOA P21397 1/20 0.42
MAOB P27338 1/20 0.42

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
SCHEMBL7916353 0.87 PDE4A (0.59) PDE4APDE4DPDE4BPDE4CMAPK1
SCHEMBL7916407 0.85 PDE4A (0.54) PDE4APDE4DPDE4BPDE4C
SCHEMBL11427405 0.85 PDE4A (0.64) PDE4APDE4DPDE4BPDE4CMAPK1
SCHEMBL7906213 0.84 PDE4A (0.52) PDE4APDE4DPDE4BPDE4C
SCHEMBL7906164 0.84 PDE4A (0.67) PDE4APDE4DPDE4BPDE4CMAPK1
SCHEMBL7919816 0.84 PDE4A (0.49) PDE4APDE4DPDE4BPDE4C
SCHEMBL7914465 0.84 PDE4A (0.48) PDE4APDE4DPDE4BPDE4CMAPK1
SCHEMBL7906202 0.82 PDE4A (0.49) PDE4APDE4DPDE4BPDE4CLMNA
SCHEMBL7913451 0.82 PDE4A (0.57) PDE4APDE4DPDE4BPDE4C
SCHEMBL7914440 0.82 PDE4A (0.68) PDE4APDE4DPDE4BPDE4CMEN1

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
US-6265402-B1 ANTIINFLAMMATORY AGENTS NIKKEN CHEMICALS CO., LTD. (JP) 2001-07-24 US disclosed
EP-0924204-A1 2-PHENYLMORPHOLIN-5-ONE DERIVATIVES AND PHARMACEUTICAL COMPOSITION COMPRISING THE SAME Nikken Chemicals Company, Limited (JP) 1999-06-23 EP disclosed