SCHEMBL7913460

SCHEMBL7913460

COc1ccc(C2CN(C)C(=O)CO2)cc1OCCc1ccc(F)cc1

nearest known ligand 0.43

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
PDE4A P27815 1/20 0.43
PDE4B Q07343 1/20 0.43
PDE4C Q08493 1/20 0.43
PDE4D Q08499 1/20 0.43
HIF1A Q16665 1/20 0.42
EPAS1 Q99814 1/20 0.42
HTR2C P28335 2/20 0.42
SIGMAR1 Q99720 2/20 0.41
SMN1; SMN2 Q16637 2/20 0.40
L3MBTL1 Q9Y468 1/20 0.40
MAPK1 P28482 1/20 0.39
FADS1 O60427 1/20 0.39
ALDH1A1 P00352 1/20 0.39
TSHR P16473 1/20 0.38
DRD4 P21917 1/20 0.38

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
SCHEMBL7913482 0.85 PDE4B (0.46) PDE4APDE4BPDE4CPDE4DSIGMAR1
SCHEMBL7919822 0.82 PDE4A (0.60) PDE4APDE4BPDE4CPDE4DSMN1; SMN2
SCHEMBL7913480 0.81 PDE4A (0.40) PDE4APDE4BPDE4CPDE4DMAPK1
SCHEMBL7914465 0.81 PDE4A (0.48) PDE4APDE4BPDE4CPDE4DHIF1A
SCHEMBL7916316 0.80 PDE4A (0.44) PDE4APDE4BPDE4CPDE4DSIGMAR1
SCHEMBL7916035 0.80 PDE4B (0.50) PDE4APDE4BPDE4CPDE4D
SCHEMBL7916410 0.80 PDE4A (0.51) PDE4APDE4BPDE4CPDE4DSMN1; SMN2
SCHEMBL6584431 0.80 HIF1A (0.47) HIF1AEPAS1HTR2CSIGMAR1SMN1; SMN2
SCHEMBL7906247 0.78 PDE4A (0.44) PDE4APDE4BPDE4CPDE4DHTR2C
SCHEMBL8310588 0.78 PDE4A (0.46) PDE4APDE4BPDE4CPDE4DSMN1; SMN2

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