SCHEMBL7906247

SCHEMBL7906247

COc1ccc(C2CN(C)C(=O)CO2)cc1OCCC1Cc2ccccc2C1

nearest known ligand 0.44

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
PDE4A P27815 12/20 0.44
PDE4B Q07343 9/20 0.44
PDE4C Q08493 7/20 0.44
PDE4D Q08499 7/20 0.44
RAB9A P51151 1/20 0.37
CYP3A4 P08684 1/20 0.36
CYP2D6 P10635 1/20 0.36
SLC6A2 P23975 1/20 0.36
SLC6A4 P31645 1/20 0.36
SLC6A3 Q01959 1/20 0.36
GABRA1 P14867 1/20 0.36
GABRB2 P47870 1/20 0.36
PTAFR P25105 1/20 0.36
SMN1; SMN2 Q16637 1/20 0.35
HTR2C P28335 1/20 0.35

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
SCHEMBL7906153 0.83 PDE4A (0.52) PDE4APDE4BPDE4CPDE4DRAB9A
SCHEMBL7906202 0.82 PDE4A (0.49) PDE4APDE4BPDE4CPDE4DCYP3A4
SCHEMBL7913482 0.82 PDE4B (0.46) PDE4APDE4BPDE4CPDE4DPTAFR
SCHEMBL7919822 0.81 PDE4A (0.60) PDE4APDE4BPDE4CPDE4DRAB9A
SCHEMBL7916316 0.81 PDE4A (0.44) PDE4APDE4BPDE4CPDE4DCYP3A4
SCHEMBL7916035 0.81 PDE4B (0.50) PDE4APDE4BPDE4CPDE4D
SCHEMBL7913480 0.79 PDE4A (0.40) PDE4APDE4BPDE4CPDE4DCYP3A4
SCHEMBL7913421 0.79 PDE4B (0.47) PDE4APDE4BPDE4CPDE4D
SCHEMBL7915930 0.79 PDE4B (0.49) PDE4APDE4BPDE4CPDE4D
SCHEMBL7916410 0.79 PDE4A (0.51) PDE4APDE4BPDE4CPDE4DRAB9A

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