SCHEMBL6909801

SCHEMBL6909801

C=CCC1CC(C)=CC1C

nearest known ligand 0.47

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
L3MBTL1 Q9Y468 1/20 0.47
SMN1; SMN2 Q16637 1/20 0.46
NOS3 P29474 1/20 0.39
NOS2 P35228 1/20 0.39
ALDH1A1 P00352 2/20 0.35
LMNA P02545 1/20 0.35
POLB P06746 1/20 0.35
APOBEC3A P31941 1/20 0.33
APOBEC3G Q9HC16 1/20 0.33

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
Methyl Alcohol SCHEMBL11305792 0.78 L3MBTL1 (0.36) L3MBTL1SMN1; SMN2NOS3NOS2ALDH1A1
SCHEMBL6909848 0.73 L3MBTL1 (0.38) L3MBTL1SMN1; SMN2NOS3NOS2
SCHEMBL5864292 0.72
SCHEMBL6904120 0.72
SCHEMBL6911638 0.72
SCHEMBL5864457 0.69 ALDH1A1 (0.40) ALDH1A1LMNAPOLBAPOBEC3AAPOBEC3G
SCHEMBL6912828 0.69 L3MBTL1 (0.38) L3MBTL1SMN1; SMN2NOS3NOS2
SCHEMBL2009007 0.69 ALDH1A1 (0.37) L3MBTL1SMN1; SMN2ALDH1A1LMNAPOLB
SCHEMBL6911837 0.67 L3MBTL1 (0.34) L3MBTL1SMN1; SMN2NOS3NOS2
SCHEMBL5864347 0.67 ALDH1A1 (0.34) ALDH1A1LMNAPOLBAPOBEC3AAPOBEC3G

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