SCHEMBL7759192

SCHEMBL7759192

C=C(C)C(=O)OC(C)COC(=O)CCCC(=O)OCC(C)OC(=O)C(=C)C

nearest known ligand 0.52

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
TSHR P16473 4/20 0.52
MAPT P10636 1/20 0.41
ALDH1A1 P00352 2/20 0.40
LMNA P02545 2/20 0.40
PRKCA P17252 3/20 0.39
PRKCE Q02156 1/20 0.37
PRKCQ Q04759 1/20 0.37
PRKCD Q05655 1/20 0.37
CYP3A4 P08684 1/20 0.37
ATM Q13315 1/20 0.37
TDP1 Q9NUW8 1/20 0.37
KDM4E B2RXH2 1/20 0.36
DUSP3 P51452 1/20 0.36
MEN1 O00255 1/20 0.36
KMT2A Q03164 1/20 0.36
EPHX2 P34913 1/20 0.35

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
SCHEMBL28061998 0.97 TSHR (0.52) TSHRMAPTALDH1A1LMNAPRKCA
SCHEMBL7759199 0.94 TSHR (0.46) TSHRMAPTALDH1A1LMNAPRKCA
SCHEMBL3914438 0.93 TSHR (0.55) TSHRMAPTALDH1A1LMNAPRKCA
SCHEMBL194350 0.91 TSHR (0.46) TSHRMAPTALDH1A1LMNAPRKCA
SCHEMBL28119132 0.91 TSHR (0.46) TSHRMAPTALDH1A1LMNAPRKCA
SCHEMBL7760377 0.87 TSHR (0.57) TSHRMAPTALDH1A1PRKCA
SCHEMBL195298 0.87 TSHR (0.49) TSHRMAPTALDH1A1LMNAPRKCA
SCHEMBL4067170 0.84 TSHR (0.53) TSHRMAPTALDH1A1LMNAPRKCA
SCHEMBL160208 0.83 TSHR (0.73) TSHRMAPTALDH1A1TDP1
SCHEMBL16803291 0.83 TSHR (0.67) TSHRMAPTALDH1A1TDP1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0756208-B1 Resin composition for electrophotographic toner, and toner comprising it MITSUI CHEMICALS INC (JP) 2001-04-11 EP disclosed
US-6011119-A RESIN COMPOSITION SHOWS EXCELLENT CHARGING CHARACTERISTICS WITHOUT A CHARGE CONTROL AGENT; HIGH AND LOW MOLECULAR WEIGHT ADDITION POLYMERS AT LEAST ONE OF WHICH IS FROM AN UNSATURATED ANHYDRIDE AND AN ACRYLOYLOXYALKYL DICARBOXYLIC ACID ESTER MITSUI CHEMICALS, INC. (JP) 2000-01-04 US disclosed
EP-0756208-A1 Resin composition for electrophotographic toner, and toner comprising it MITSUI TOATSU CHEMICALS, INCORPORATED (JP) 1997-01-29 EP disclosed