SCHEMBL3341803

SCHEMBL3341803

O=[N+]([O-])C1=CC(=NCc2cccnc2-c2ccc3ccccc3c2)C(O)C=C1

nearest known ligand 0.32

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
PDE4D Q08499 2/20 0.32
PDE4A P27815 1/20 0.31
PDE4C Q08493 1/20 0.31

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
SCHEMBL3341800 0.71 PDE4D (0.33) PDE4DPDE4APDE4C
SCHEMBL3347655 0.70 ALDH1A1 (0.37)
SCHEMBL1736475 0.66 PDE10A (0.51) PDE4DPDE4APDE4C
SCHEMBL3341798 0.66
SCHEMBL3346025 0.64 HTR2B (0.32)
SCHEMBL884693 0.60 CYP11B1 (0.50)
SCHEMBL4094629 0.58 KDM4E (0.61)
SCHEMBL28047085 0.58 MAPK9 (0.54)
SCHEMBL7236603 0.57 PDE4D (0.61) PDE4DPDE4APDE4C
SCHEMBL31032063 0.57 PARP1 (0.51)

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-2010550-B1 POLYMERISATION OF ETHYLENE AND ALPHA-OLEFINS WITH PYRIDINO-IMINOPHENOL COMPLEXES TOTAL RES & TECHNOLOGY FELUY (BE) 2013-06-19 EP disclosed
US-8399582-B2 Polymerisation of ethylene and alpha-olefins with pyridino-iminophenol complexes TOTAL PETROCHEMICALS RESEARCH FELUY (BE) 2013-03-19 US disclosed
US-20100160583-A1 Polymerisation of Ethylene and Alpha-Olefins with Pyridino-Iminophenol Complexes TOTAL PETROCHEMICALS RESEARCH FEULY (BE) 2010-06-24 US disclosed
EP-1849791-A1 Polymerisation of ethylene and alpha-olefins with pyridino-iminophenol complexes TOTAL PETROCHEMICALS RESEARCH FELUY (BE) 2007-10-31 EP disclosed