SCHEMBL5864342

SCHEMBL5864342

CNCCCC1CC=CC1

nearest known ligand 0.47

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
SIGMAR1 Q99720 1/20 0.47
HTR2A P28223 3/20 0.39
HRH1 P35367 3/20 0.39
KDM4E B2RXH2 2/20 0.36
LMNA P02545 1/20 0.36
TP53 P04637 1/20 0.36
CHRM2 P08172 1/20 0.36
CYP3A4 P08684 1/20 0.36
CYP2D6 P10635 1/20 0.36
CHRM1 P11229 1/20 0.36
DRD2 P14416 1/20 0.36
ADRA2B P18089 1/20 0.36
ADRA2C P18825 1/20 0.36
NFKB1 P19838 1/20 0.36
CHRM3 P20309 1/20 0.36
SLC6A2 P23975 1/20 0.36
HTR2C P28335 1/20 0.36
ADRA1A P35348 1/20 0.36
DRD3 P35462 1/20 0.36
THPO P40225 1/20 0.36

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
SCHEMBL509838 0.86 SIGMAR1 (0.44) SIGMAR1HTR2AHRH1KDM4ELMNA
SCHEMBL5864474 0.85
SCHEMBL920031 0.77
SCHEMBL2140363 0.76 SIGMAR1 (0.31) SIGMAR1
SCHEMBL2140278 0.73 SIGMAR1 (0.35) SIGMAR1
SCHEMBL919205 0.73
SCHEMBL1858791 0.73 SIGMAR1 (0.79) SIGMAR1HTR2AHRH1MEN1KMT2A
SCHEMBL7980400 0.72
SCHEMBL27368119 0.71 SIGMAR1 (0.83) SIGMAR1MEN1KMT2AMAPTEPHX1
SCHEMBL1859093 0.71 SIGMAR1 (0.83) SIGMAR1MEN1KMT2AMAPTEPHX1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1066337-B1 OXYGEN SCAVENGERS WITH REDUCED OXIDATION PRODUCTS FOR USE IN PLASTIC FILMS AND BEVERAGE AND FOOD CONTAINERS CHEVRON PHILLIPS CHEMICAL CO (US) 2004-11-03 EP claimed
EP-1066337-A2 OXYGEN SCAVENGERS WITH REDUCED OXIDATION PRODUCTS FOR USE IN PLASTIC FILMS AND BEVERAGE AND FOOD CONTAINERS CHEVRON PHILLIPS CHEMICAL COMPANY LP (US) 2001-01-10 EP claimed
WO-1999048963-A2 OXYGEN SCAVENGERS WITH REDUCED OXIDATION PRODUCTS FOR USE IN PLASTIC FILMS AND BEVERAGE AND FOOD CONTAINERS CHEVRON PHILLIPS CHEMICAL COMPANY LP (US) 1999-09-30 WO claimed
US-7097890-B1 Polymer with pendent cyclic olefinic functions for oxygen scavenging packaging CHEVRON PHILLIPS CHEMICAL CO. LP (US) 2006-08-29 US disclosed
EP-1066337-B1 OXYGEN SCAVENGERS WITH REDUCED OXIDATION PRODUCTS FOR USE IN PLASTIC FILMS AND BEVERAGE AND FOOD CONTAINERS CHEVRON PHILLIPS CHEMICAL CO (US) 2004-11-03 EP disclosed
EP-1066337-A2 OXYGEN SCAVENGERS WITH REDUCED OXIDATION PRODUCTS FOR USE IN PLASTIC FILMS AND BEVERAGE AND FOOD CONTAINERS CHEVRON PHILLIPS CHEMICAL COMPANY LP (US) 2001-01-10 EP disclosed
WO-1999048963-A2 OXYGEN SCAVENGERS WITH REDUCED OXIDATION PRODUCTS FOR USE IN PLASTIC FILMS AND BEVERAGE AND FOOD CONTAINERS CHEVRON PHILLIPS CHEMICAL COMPANY LP (US) 1999-09-30 WO disclosed