SCHEMBL3844967

SCHEMBL3844967

CC1=CC=C(O)C(=NC(O)c2ccccn2)C1

nearest known ligand 0.39

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TP53 P04637 1/20 0.35
KDM4E B2RXH2 2/20 0.33
KCNA5 P22460 5/20 0.32
TSHR P16473 1/20 0.32
KCNE1 P15382 1/20 0.32
SLC6A2 P23975 1/20 0.32
SLC6A4 P31645 1/20 0.32
SLC6A3 Q01959 1/20 0.32
MEN1 O00255 2/20 0.32
GAA P10253 2/20 0.32
KMT2A Q03164 2/20 0.32
SMN1; SMN2 Q16637 1/20 0.32
CYP1A2 P05177 2/20 0.31
CYP3A4 P08684 1/20 0.31
BRD4 O60885 1/20 0.31
ALDH1A1 P00352 2/20 0.31
KCNH2 Q12809 1/20 0.31
CYP2C19 P33261 1/20 0.30
MAPT P10636 2/20 0.30
USP2 O75604 1/20 0.30

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
SCHEMBL3851781 0.84 TRPV3 (0.34) TP53KDM4EKCNA5KCNE1SLC6A2
SCHEMBL3849156 0.83 IDH1 (0.35) TP53KDM4EKCNA5TSHRKCNE1
SCHEMBL3844520 0.82 KDM4E (0.34) TP53KDM4EKCNA5KCNE1SLC6A2
SCHEMBL3845006 0.80 TSHR (0.36) TP53KDM4EKCNA5TSHRKCNE1
SCHEMBL3849158 0.75 TP53 (0.34) TP53KDM4EKCNA5TSHRKCNE1
SCHEMBL27563049 0.61
SCHEMBL507506 0.61
SCHEMBL2584363 0.61
SCHEMBL29609775 0.61
SCHEMBL1193974 0.61

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
EP-2010550-A1 POLYMERISATION OF ETHYLENE AND ALPHA-OLEFINS WITH PYRIDINO-IMINOPHENOL COMPLEXES TOTAL PETROCHEMICALS RESEARCH FELUY (BE) 2009-01-07 EP disclosed
WO-2007122139-A1 POLYMERISATION OF ETHYLENE AND ALPHA-OLEFINS WITH PYRIDINO-IMINOPHENOL COMPLEXES TOTAL PETROCHEMICALS RESEARCH FELUY (BE) 2007-11-01 WO disclosed