SCHEMBL6905685

SCHEMBL6905685

CC(N)CC1CC=CCC1

nearest known ligand 0.48

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 5/20 0.36
ALDH1A1 P00352 4/20 0.36
TDP1 Q9NUW8 2/20 0.36
POLB P06746 1/20 0.33
PKM P14618 1/20 0.33
HSD17B10 Q99714 1/20 0.31
CDK1 P06493 2/20 0.31
CCNB1 P14635 2/20 0.31
CCNA2 P20248 2/20 0.31
CDK2 P24941 2/20 0.31
CCNA1 P78396 2/20 0.31
MAPK1 P28482 1/20 0.30
ALOX15 P16050 1/20 0.30
CYP1A2 P05177 1/20 0.30
CYP2D6 P10635 1/20 0.30
CYP2C19 P33261 1/20 0.30

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
SCHEMBL6910092 0.84
SCHEMBL6910876 0.84 KDM4E (0.35) KDM4EALDH1A1TDP1POLBPKM
SCHEMBL1525278 0.83 KDM4E (0.41) KDM4EALDH1A1TDP1POLBPKM
SCHEMBL6907802 0.80 KDM4E (0.35) KDM4EALDH1A1TDP1POLBPKM
SCHEMBL6911566 0.80 KDM4E (0.35) KDM4EALDH1A1TDP1POLBPKM
SCHEMBL12532460 0.79 KDM4E (0.39) KDM4EALDH1A1TDP1POLBPKM
SCHEMBL18030165 0.79 KDM4E (0.39) KDM4EALDH1A1TDP1POLBPKM
SCHEMBL27311648 0.78 KDM4E (0.40) KDM4EALDH1A1TDP1POLBPKM
SCHEMBL9185685 0.77 KDM4E (0.45) KDM4EALDH1A1TDP1POLBPKM
SCHEMBL13128070 0.76 KDM4E (0.36) KDM4EALDH1A1TDP1PKMHSD17B10

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