SCHEMBL28014471

SCHEMBL28014471

CC(COC(=O)CCC(=O)OCC(C)C(C)C(F)(F)F)C(C)C(F)(F)F

nearest known ligand 0.38

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPT P10636 3/20 0.38
LMNA P02545 2/20 0.33
ALDH1A1 P00352 2/20 0.33
TSHR P16473 2/20 0.33
ADRA2A P08913 1/20 0.33
ADRA1A P35348 1/20 0.33
CYP3A4 P08684 1/20 0.33
ATM Q13315 1/20 0.33
TDP1 Q9NUW8 1/20 0.33
KDM4E B2RXH2 1/20 0.33
DUSP3 P51452 1/20 0.33
MEN1 O00255 1/20 0.33
KMT2A Q03164 1/20 0.33
BLM P54132 1/20 0.32
POLB P06746 1/20 0.31
GAA P10253 1/20 0.31
PRKCA P17252 1/20 0.31
PRKCE Q02156 1/20 0.31
PRKCQ Q04759 1/20 0.31
PRKCD Q05655 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
SCHEMBL28014472 0.93 EGLN1 (0.36) MAPTLMNAALDH1A1TSHRCYP3A4
SCHEMBL28014426 0.76 MAPT (0.44) MAPTLMNAALDH1A1TSHRADRA2A
SCHEMBL13395763 0.71 ALDH1A1 (0.56) MAPTLMNAALDH1A1TSHRADRA2A
SCHEMBL13395764 0.71 ALDH1A1 (0.56) MAPTLMNAALDH1A1TSHRADRA2A
SCHEMBL334176 0.71 TSHR (0.50) MAPTLMNAALDH1A1TSHRADRA2A
SCHEMBL28875656 0.69 EGLN1 (0.42) MAPTLMNAALDH1A1TSHRADRA2A
SCHEMBL29045653 0.69 MAPT (0.40) MAPTLMNAALDH1A1TSHRCYP3A4
SCHEMBL822396 0.69 MAPT (0.67) MAPTLMNAALDH1A1TSHRADRA2A
SCHEMBL30529014 0.69 TSHR (0.48) MAPTLMNAALDH1A1TSHRADRA2A
SCHEMBL27561555 0.69 TSHR (0.48) MAPTLMNAALDH1A1TSHRADRA2A

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
CN-104736627-A Propylene resin composition for retort pouch-packaging film SUN ALLOMER LTD 2015-06-24 CN disclosed