SCHEMBL13664139

SCHEMBL13664139

CCC(C)/C=N\Nc1ccccc1

nearest known ligand 0.46

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
NOX1 Q9Y5S8 2/20 0.46
GAA P10253 8/20 0.44
MAPT P10636 10/20 0.42
KDM4E B2RXH2 3/20 0.42
ALDH1A1 P00352 6/20 0.40
LMNA P02545 4/20 0.40
SMN1; SMN2 Q16637 3/20 0.40
ALOX12 P18054 2/20 0.40
KMT2A Q03164 5/20 0.40
RAB9A P51151 5/20 0.40
MEN1 O00255 4/20 0.40
HPGD P15428 3/20 0.40
GFER P55789 1/20 0.40
GPR39 O43194 1/20 0.38
TDP1 Q9NUW8 3/20 0.38
NPC1 O15118 2/20 0.38
MAPK1 P28482 2/20 0.36
SENP7 Q9BQF6 1/20 0.35
NPSR1 Q6W5P4 1/20 0.35
MAOA P21397 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
SCHEMBL13664138 0.80 NOX1 (0.52) NOX1GAAMAPTKDM4EALDH1A1
SCHEMBL2483049 0.80 NOX1 (0.52) NOX1GAAMAPTKDM4EALDH1A1
SCHEMBL2483052 0.80 NOX1 (0.52) NOX1GAAMAPTKDM4EALDH1A1
SCHEMBL3278077 0.77 NOX1 (0.48) NOX1GAAMAPTKDM4EALDH1A1
SCHEMBL11714851 0.76 MAPT (0.50) NOX1GAAMAPTKDM4EALDH1A1
SCHEMBL24784479 0.73 NOX1 (0.35) NOX1GAAMAPTKDM4EALDH1A1
SCHEMBL11583762 0.72 NOX1 (0.52) NOX1GAAMAPTKDM4EALDH1A1
SCHEMBL11583765 0.72 NOX1 (0.52) NOX1GAAMAPTKDM4EALDH1A1
SCHEMBL14067436 0.72 NOX1 (0.52) NOX1GAAMAPTKDM4EALDH1A1
SCHEMBL13664517 0.72 ASF1A (0.50) NOX1GAAMAPTKDM4EALDH1A1

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 1 patent. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20090263906-A1 METHOD OF ANTIOXIDATIVE FUNCTIONAL ESTIMATION USING ANIMAL MODEL KOREA ATOMIC ENERGY RESEARCH INSTITUTE (KR) 2009-10-22 US disclosed