SCHEMBL4091598

SCHEMBL4091598

CC(C)COC(=O)CCCCC(=O)OCC(C)C.COC(=O)CCCCC(=O)OC

nearest known ligand 0.56

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
TSHR P16473 4/20 0.56
MAPT P10636 1/20 0.52
LMNA P02545 3/20 0.50
ALDH1A1 P00352 2/20 0.50
EPHX2 P34913 1/20 0.48
CYP3A4 P08684 1/20 0.46
ATM Q13315 1/20 0.46
TDP1 Q9NUW8 1/20 0.46
MEN1 O00255 2/20 0.44
KMT2A Q03164 2/20 0.44
KDM4E B2RXH2 1/20 0.44
DUSP3 P51452 1/20 0.44
PRKCA P17252 1/20 0.42
PRKCE Q02156 1/20 0.42
PRKCQ Q04759 1/20 0.42
PRKCD Q05655 1/20 0.42
DGKA P23743 1/20 0.41

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
Formaldehyde SCHEMBL28213876 0.94 LMNA (0.55) TSHRMAPTLMNAALDH1A1EPHX2
SCHEMBL3944331 0.91 TSHR (0.59) TSHRMAPTLMNAALDH1A1EPHX2
SCHEMBL42941 0.91 MAPT (0.59) TSHRMAPTLMNAALDH1A1EPHX2
SCHEMBL28136838 0.91 MAPT (0.67) MAPTLMNAALDH1A1MEN1KMT2A
SCHEMBL495250 0.89 MAPT (0.62) TSHRMAPTLMNAALDH1A1EPHX2
SCHEMBL494408 0.89 MAPT (0.62) TSHRMAPTLMNAALDH1A1EPHX2
SCHEMBL16005767 0.89 MAPT (0.57) TSHRMAPTLMNAALDH1A1EPHX2
SCHEMBL495197 0.89 MAPT (0.62) TSHRMAPTLMNAALDH1A1EPHX2
SCHEMBL496450 0.89 MAPT (0.62) TSHRMAPTLMNAALDH1A1EPHX2
SCHEMBL1977708 0.89 MAPT (0.62) TSHRMAPTLMNAALDH1A1EPHX2

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
US-20090099293-A1 FLAME RETARDANT RUBBER COMPOSITION AND OBTAINED THEREFROM, RUBBER PRODUCT AND ELECTRIC WIRE COATING MATERIAL JRS CORPORATION (JP) 2009-04-16 US disclosed