SCHEMBL8962182

SCHEMBL8962182

NCCCCCCNC(=O)C(N)=O

nearest known ligand 0.59

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PAOX Q6QHF9 3/20 0.59
MAOA P21397 1/20 0.52
MAOB P27338 1/20 0.52
GNAI3 P08754 1/20 0.47
GNAO1 P09471 1/20 0.47
GNAI1 P63096 1/20 0.47
GAA P10253 1/20 0.44
SLC6A5 Q9Y345 2/20 0.41
KDM4E B2RXH2 1/20 0.41
MAPK1 P28482 1/20 0.41
HIF1A Q16665 1/20 0.41
ALDH1A1 P00352 2/20 0.39
MEN1 O00255 1/20 0.39
PLG P00747 1/20 0.39
LMNA P02545 1/20 0.39
THRB P10828 1/20 0.39
ALOX15 P16050 1/20 0.39
SLC6A2 P23975 1/20 0.39
RECQL P46063 1/20 0.39
SLC6A3 Q01959 1/20 0.39

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
SCHEMBL27881751 0.91 GAA (0.47) PAOXMAOAMAOBGNAI3GNAO1
SCHEMBL11593047 0.89 SLC6A5 (0.56) PAOXMAOAMAOBGNAI3GNAO1
SCHEMBL7209763 0.88 PAOX (0.67) PAOXMAOAMAOBGNAI3GNAO1
SCHEMBL7211245 0.88 PAOX (0.67) PAOXMAOAMAOBGNAI3GNAO1
SCHEMBL7210069 0.88 PAOX (0.67) PAOXMAOAMAOBGNAI3GNAO1
SCHEMBL7214675 0.88 PAOX (0.67) PAOXMAOAMAOBGNAI3GNAO1
SCHEMBL8962152 0.88 PAOX (0.67) PAOXMAOAMAOBGNAI3GNAO1
SCHEMBL15201198 0.88 GAA (0.52) PAOXGAAKDM4EMAPK1HIF1A
SCHEMBL27900393 0.87 CA12 (0.54) PAOXMAOAMAOBMEN1LMNA
SCHEMBL7209838 0.86 PAOX (0.64) PAOXMAOAMAOBGNAI3GNAO1

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
EP-0515553-B1 OXYGEN BARRIER EXXON CHEMICAL PATENTS INC (US) 1996-02-07 EP disclosed