SCHEMBL27638643

SCHEMBL27638643

C=C(OCCOCCOCCO)C(=O)O

nearest known ligand 0.48

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 2/20 0.48
KMT2A Q03164 2/20 0.48
TSHR P16473 6/20 0.43
MAPK1 P28482 1/20 0.43
ALDH1A1 P00352 4/20 0.40
TP53 P04637 2/20 0.40
HIF1A Q16665 2/20 0.40
HSD17B10 Q99714 2/20 0.40
THRB P10828 2/20 0.35
HTT P42858 1/20 0.34
MAPT P10636 1/20 0.34
PEPD P12955 1/20 0.32
BLM P54132 1/20 0.30
PMP22 Q01453 1/20 0.30
EPHX2 P34913 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
SCHEMBL10701098 1.00 MEN1 (0.48) MEN1KMT2ATSHRMAPK1ALDH1A1
SCHEMBL5984069 1.00 MEN1 (0.48) MEN1KMT2ATSHRMAPK1ALDH1A1
SCHEMBL252209 0.86
Di(Hydroxyethyl)Ether SCHEMBL9056057 0.83 ALDH1A1 (0.44) MEN1KMT2ATSHRMAPK1ALDH1A1
SCHEMBL28963874 0.83 MEN1 (0.48) MEN1KMT2ATSHRMAPK1ALDH1A1
SCHEMBL29102623 0.81 THRB (0.57) TSHRALDH1A1TP53HIF1AHSD17B10
SCHEMBL28440922 0.81 THRB (0.57) TSHRALDH1A1TP53HIF1AHSD17B10
SCHEMBL28423063 0.81 MEN1 (0.46) MEN1KMT2ATSHRMAPK1ALDH1A1
SCHEMBL29222995 0.81 THRB (0.57) TSHRALDH1A1TP53HIF1AHSD17B10
SCHEMBL28416144 0.81 MEN1 (0.46) MEN1KMT2ATSHRMAPK1ALDH1A1

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-100364649-C Aqueous emulsion polymer as dispersant EFKA ADDITIVES B V (NL) 2008-01-30 CN disclosed
CN-1713955-A Aqueous emulsion polymers as dispersants EFKA ADDITIVES B V (NL) 2005-12-28 CN disclosed