SCHEMBL27932115

SCHEMBL27932115

C=CC(=O)NCC(C)CC(C)C(=O)O

nearest known ligand 0.42

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
TSHR P16473 2/20 0.42
ALDH1A1 P00352 2/20 0.42
MAPK1 P28482 1/20 0.42
TDP1 Q9NUW8 1/20 0.42
NAALAD2 Q9Y3Q0 3/20 0.39
FOLH1 Q04609 2/20 0.39
ZDHHC20 Q5W0Z9 1/20 0.37
ZDHHC2 Q9UIJ5 1/20 0.37
ENPEP Q07075 2/20 0.35
GFPT1 Q06210 1/20 0.33
CYP2D6 P10635 1/20 0.32
CYP2C19 P33261 1/20 0.32
MAPT P10636 1/20 0.32
BLM P54132 1/20 0.32
GABRR1 P24046 2/20 0.31
CYP1A2 P05177 1/20 0.31
TGM2 P21980 1/20 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
SCHEMBL2472280 0.85 TSHR (0.48) TSHRALDH1A1MAPK1TDP1NAALAD2
SCHEMBL18755013 0.82 TSHR (0.54) TSHRALDH1A1MAPK1TDP1ZDHHC20
SCHEMBL29531590 0.81 TSHR (0.48) TSHRALDH1A1MAPK1TDP1ZDHHC20
SCHEMBL27686070 0.78 TSHR (0.45) TSHRALDH1A1MAPK1TDP1ZDHHC20
SCHEMBL799424 0.77 TSHR (0.48) TSHRALDH1A1MAPK1TDP1ZDHHC20
SCHEMBL8525778 0.76 TSHR (0.46) TSHRALDH1A1MAPK1TDP1ZDHHC20
SCHEMBL3498593 0.75 TSHR (0.42) TSHRALDH1A1MAPK1TDP1ZDHHC20
SCHEMBL28554680 0.75 TSHR (0.50) TSHRALDH1A1MAPK1TDP1ZDHHC20
SCHEMBL372689 0.74
SCHEMBL24652900 0.74 TSHR (0.45) TSHRALDH1A1MAPK1TDP1ZDHHC20

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
CN-103224593-B A kind of method of linear low density polyethylene grafting of polar monomers HARBIN ENGINEERING UNIV. (CN) 2015-12-09 CN claimed
CN-103232575-A Preparation method for solid unsaturated carboxylic acid-functionalized linear low density polyethylene UNIV HARBIN ENG 2013-08-07 CN claimed
CN-103224593-A Method for grafting linear low density polyethylene to polar monomer UNIV HARBIN ENG 2013-07-31 CN claimed
CN-103224593-B A kind of method of linear low density polyethylene grafting of polar monomers HARBIN ENGINEERING UNIV. (CN) 2015-12-09 CN disclosed
CN-103232575-B Preparation method for solid unsaturated carboxylic acid-functionalized linear low density polyethylene UNIV HARBIN ENG 2015-05-27 CN disclosed
CN-103232575-A Preparation method for solid unsaturated carboxylic acid-functionalized linear low density polyethylene UNIV HARBIN ENG 2013-08-07 CN disclosed
CN-103224593-A Method for grafting linear low density polyethylene to polar monomer UNIV HARBIN ENG 2013-07-31 CN disclosed