SCHEMBL5873439

SCHEMBL5873439

OCC(O)C(O)C(O)C(O)C(O)C(O)C(O)C(O)C(O)c1ccccc1

nearest known ligand 0.50

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TDP1 Q9NUW8 1/20 0.50
L3MBTL1 Q9Y468 2/20 0.46
LMNA P02545 3/20 0.46
AOC3 Q16853 2/20 0.46
ALDH1A1 P00352 3/20 0.44
KDM4E B2RXH2 2/20 0.44
SLC6A2 P23975 2/20 0.42
SLC6A4 P31645 2/20 0.42
SLC6A3 Q01959 2/20 0.42
ADRA2C P18825 2/20 0.42
ADRA2A P08913 1/20 0.42
HIF1A Q16665 1/20 0.42
CHRM2 P08172 1/20 0.39
ADRA1A P35348 1/20 0.39
RGS12 O14924 1/20 0.39
GLA P06280 1/20 0.39
CYP3A4 P08684 1/20 0.39
CYP2D6 P10635 1/20 0.39
CYP2C9 P11712 1/20 0.39
PKM P14618 1/20 0.39

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
SCHEMBL27825950 1.00 TDP1 (0.50) TDP1L3MBTL1LMNAAOC3ALDH1A1
SCHEMBL4077892 1.00 TDP1 (0.50) TDP1L3MBTL1LMNAAOC3ALDH1A1
Alcohol SCHEMBL28032136 0.94 AOC3 (0.46) TDP1L3MBTL1LMNAAOC3ALDH1A1
SCHEMBL550791 0.91 AOC3 (0.48) TDP1L3MBTL1LMNAAOC3ALDH1A1
SCHEMBL551822 0.91 AOC3 (0.48) TDP1L3MBTL1LMNAAOC3ALDH1A1
SCHEMBL550790 0.91 AOC3 (0.48) TDP1L3MBTL1LMNAAOC3ALDH1A1
SCHEMBL3389900 0.91 AOC3 (0.48) TDP1L3MBTL1LMNAAOC3ALDH1A1
SCHEMBL117950 0.87 SLC6A2 (0.54) L3MBTL1LMNAAOC3ALDH1A1KDM4E
SCHEMBL30801376 0.87 SLC6A2 (0.54) L3MBTL1LMNAAOC3ALDH1A1KDM4E
SCHEMBL8075340 0.82 TDP1 (0.48) TDP1L3MBTL1LMNAAOC3KDM4E

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-6989052-B1 Phase change ink printing process XEROX CORPORATION (US) 2006-01-24 US claimed