SCHEMBL8962152

SCHEMBL8962152

NCCCCCCNC(=O)C(=O)NCCCCCCN

nearest known ligand 0.67

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PAOX Q6QHF9 4/20 0.67
MAOA P21397 1/20 0.52
MAOB P27338 1/20 0.52
GNAI3 P08754 1/20 0.52
GNAO1 P09471 1/20 0.52
GNAI1 P63096 1/20 0.52
KDM4E B2RXH2 1/20 0.46
MAPK1 P28482 1/20 0.46
HIF1A Q16665 1/20 0.46
SLC6A5 Q9Y345 2/20 0.44
ALDH1A1 P00352 2/20 0.44
ALOX15 P16050 2/20 0.44
LMNA P02545 2/20 0.44
MEN1 O00255 1/20 0.44
PLG P00747 1/20 0.44
THRB P10828 1/20 0.44
SLC6A2 P23975 1/20 0.44
RECQL P46063 1/20 0.44
SLC6A3 Q01959 1/20 0.44
KMT2A Q03164 1/20 0.44

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
SCHEMBL7211245 1.00 PAOX (0.67) PAOXMAOAMAOBGNAI3GNAO1
SCHEMBL7209763 1.00 PAOX (0.67) PAOXMAOAMAOBGNAI3GNAO1
SCHEMBL7214675 1.00 PAOX (0.67) PAOXMAOAMAOBGNAI3GNAO1
SCHEMBL7210069 1.00 PAOX (0.67) PAOXMAOAMAOBGNAI3GNAO1
SCHEMBL7209838 0.97 PAOX (0.64) PAOXMAOAMAOBGNAI3GNAO1
SCHEMBL20561185 0.97 PAOX (0.62) PAOXMAOAMAOBGNAI3GNAO1
SCHEMBL7214660 0.92 PAOX (0.58) PAOXMAOAMAOBGNAI3GNAO1
SCHEMBL6892383 0.89 PAOX (0.52) PAOXMAOAMAOBGNAI3GNAO1
SCHEMBL8962182 0.88 PAOX (0.59) PAOXMAOAMAOBGNAI3GNAO1
SCHEMBL12353013 0.84 PAOX (0.67) 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 5 patents. 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
US-5223603-A Reaction of diamine with oxalic acid EXXON CHEMICAL PATENTS INC. (US) 1993-06-29 US disclosed
EP-0515553-A1 OXYGEN BARRIER. EXXON CHEMICAL PATENTS INC (US) 1992-12-02 EP disclosed
US-5093466-A Food packaging EXXON CHEMICAL PATENTS INC. (US) 1992-03-03 US disclosed
WO-1991013113-A1 OXYGEN BARRIER EXXON CHEMICAL PATENTS INC. (US) 1991-09-05 WO disclosed