Ether

Ether

SCHEMBL28205262

CC(O)C(O)CO.CCOCC

nearest known ligand 0.40

Full drug profile on Sugi Atlas →

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
TDP1 Q9NUW8 2/20 0.38
ALDH1A1 P00352 1/20 0.38
LMNA P02545 2/20 0.36
L3MBTL1 Q9Y468 1/20 0.36
TSHR P16473 3/20 0.33
HSD17B10 Q99714 1/20 0.32
KDM4E B2RXH2 2/20 0.31
USP2 O75604 1/20 0.30

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
E968 SCHEMBL578415 0.86 ALDH1A1 (0.43) TDP1ALDH1A1LMNAL3MBTL1TSHR
SCHEMBL29888723 0.83
SCHEMBL11031370 0.83
SCHEMBL9765967 0.83
SCHEMBL1926252 0.83
SCHEMBL14948561 0.83
SCHEMBL50023 0.83
Mannitol SCHEMBL3909131 0.81 LMNA (0.61) TDP1ALDH1A1LMNAL3MBTL1KDM4E
Xylitol SCHEMBL20561020 0.81 LMNA (0.53) TDP1ALDH1A1LMNAL3MBTL1KDM4E
Sorbitol SCHEMBL619756 0.81 LMNA (0.61) TDP1ALDH1A1LMNAL3MBTL1KDM4E

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
CN-107922886-A Liquid detergent composition for clothes 花王株式会社 2018-04-17 CN disclosed
CN-104884601-B Dress material liquid cleanser composition 花王株式会社 2018-02-13 CN disclosed