SCHEMBL5492445

SCHEMBL5492445

C=CCOC(=O)OC(=O)OC(=O)OC=O

nearest known ligand 0.38

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
MAPT P10636 1/20 0.38
CACNA1B Q00975 1/20 0.38
APBA1 Q02410 1/20 0.38
CYP3A4 P08684 1/20 0.36
TSHR P16473 2/20 0.34
SOAT1 P35610 1/20 0.33
PKM P14618 1/20 0.32
SMN1; SMN2 Q16637 1/20 0.32
ALDH1A1 P00352 1/20 0.32
HSD17B10 Q99714 1/20 0.32
TDP1 Q9NUW8 1/20 0.32

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
SCHEMBL3277365 0.98 MAPT (0.39) MAPTCACNA1BAPBA1CYP3A4TSHR
SCHEMBL925667 0.87
SCHEMBL9110969 0.87 CYP3A4 (0.43) MAPTCACNA1BAPBA1CYP3A4TSHR
SCHEMBL47912 0.85 CYP3A4 (0.45) MAPTCACNA1BAPBA1CYP3A4TSHR
Ethylene Glycol SCHEMBL1923456 0.79 CYP3A4 (0.41) MAPTCACNA1BAPBA1CYP3A4TSHR
SCHEMBL28799412 0.78 MAPT (0.41) MAPTCACNA1BAPBA1CYP3A4TSHR
SCHEMBL6682613 0.78 SOAT1 (0.30) SOAT1
SCHEMBL6684168 0.78 SOAT1 (0.30) SOAT1
Vinyl Ether SCHEMBL9746679 0.77 CYP3A4 (0.39) MAPTCACNA1BAPBA1CYP3A4TSHR
SCHEMBL7096132 0.75 SOAT1 (0.65) MAPTCACNA1BAPBA1CYP3A4TSHR

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8642181-B2 Metal-clad white laminate MITSUBISHI GAS CHEMICAL COMPANY, INC. (JP) 2014-02-04 US disclosed
US-20070292709-A1 Metal-Clad White Laminate MITSUBISHI GAS CHEMICAL COMPANY, INC. (JP) 2007-12-20 US disclosed