SCHEMBL28801074

SCHEMBL28801074

CCCCOC(=O)CCCC(O)CCC.[H+]

nearest known ligand 0.52

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
DGKA P23743 1/20 0.52
KDM4E B2RXH2 1/20 0.46
DUSP3 P51452 1/20 0.46
MEN1 O00255 1/20 0.46
KMT2A Q03164 1/20 0.46
LMNA P02545 1/20 0.46
NFKB1 P19838 1/20 0.46
ALDH1A1 P00352 2/20 0.45
MAPT P10636 1/20 0.45
L3MBTL1 Q9Y468 1/20 0.45
DNM1 Q05193 1/20 0.44
CYP3A4 P08684 1/20 0.44
TSHR P16473 1/20 0.44
ATM Q13315 1/20 0.44
TDP1 Q9NUW8 1/20 0.44
FFAR4 Q5NUL3 1/20 0.43
FFAR1 O14842 1/20 0.43
NAAA Q02083 1/20 0.43
HTR2C P28335 1/20 0.42
PRSS1 P07477 1/20 0.42

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
SCHEMBL14714687 0.98 DGKA (0.53) DGKAKDM4EDUSP3MEN1KMT2A
SCHEMBL29290002 0.89 DGKA (0.50) DGKAKDM4EDUSP3MEN1KMT2A
SCHEMBL19817389 0.89 DGKA (0.55) DGKAKDM4EDUSP3MEN1KMT2A
SCHEMBL27157452 0.88 DGKA (0.63) DGKAKDM4EDUSP3MEN1KMT2A
SCHEMBL22028549 0.87 DGKA (0.47) DGKAKDM4EDUSP3MEN1KMT2A
SCHEMBL29244078 0.87 DGKA (0.62) DGKAKDM4EDUSP3MEN1KMT2A
SCHEMBL1683778 0.86 DGKA (0.67) DGKAKDM4EDUSP3MEN1KMT2A
SCHEMBL21585874 0.86 DGKA (0.67) DGKAKDM4EDUSP3MEN1KMT2A
SCHEMBL17507920 0.86 DGKA (0.50) DGKAKDM4EDUSP3MEN1KMT2A
SCHEMBL20772828 0.86 DGKA (0.55) DGKAKDM4EDUSP3MEN1KMT2A

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-102946994-B Nanometer-sized copper-based catalyst, production method thereof, and alcohol production method using the same through direct hydrogenation of carboxylic acid SK INNOVATION CO LTD 2015-03-18 CN disclosed
CN-102946994-A Nanometer-sized copper-based catalyst, production method thereof, and alcohol production method using the same through direct hydrogenation of carboxylic acid SK INNOVATION CO LTD 2013-02-27 CN disclosed