SCHEMBL6911795

SCHEMBL6911795

C=CCC1CC(C)=C(C)C1

nearest known ligand 0.38

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
L3MBTL1 Q9Y468 1/20 0.38
NOS3 P29474 3/20 0.37
NOS2 P35228 3/20 0.37
SMN1; SMN2 Q16637 1/20 0.37
NOS1 P29475 2/20 0.31

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
SCHEMBL6907723 0.84 NOS3 (0.34) L3MBTL1NOS3NOS2SMN1; SMN2NOS1
SCHEMBL8549395 0.76
SCHEMBL6911837 0.72 L3MBTL1 (0.34) L3MBTL1NOS3NOS2SMN1; SMN2
SCHEMBL6905304 0.70
SCHEMBL10688107 0.70 ALDH1A1 (0.39) NOS3NOS2NOS1
SCHEMBL6909009 0.69
SCHEMBL4081457 0.69 PRSS1 (0.38)
SCHEMBL6911346 0.68 L3MBTL1 (0.39) L3MBTL1NOS3NOS2SMN1; SMN2
SCHEMBL815076 0.67 NOS1 (0.37) NOS3NOS2NOS1
SCHEMBL432351 0.67

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-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