SCHEMBL29061111

SCHEMBL29061111

O=C(CCCCCCCCC(=O)ONC1CCCCC1)ONC1CCCCC1

nearest known ligand 0.50

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
EPHX2 P34913 3/20 0.50
SMN1; SMN2 Q16637 1/20 0.47
NAAA Q02083 2/20 0.46
HDAC3 O15379 2/20 0.44
HDAC1 Q13547 2/20 0.44
HDAC2 Q92769 2/20 0.44
HDAC10 Q969S8 2/20 0.44
HDAC11 Q96DB2 2/20 0.44
HDAC8 Q9BY41 2/20 0.44
HDAC6 Q9UBN7 2/20 0.44
NCOR2 Q9Y618 1/20 0.44
EPHX1 P07099 6/20 0.42
ALDH1A1 P00352 2/20 0.42
GAA P10253 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
SCHEMBL11325844 0.98 SMN1; SMN2 (0.48) EPHX2SMN1; SMN2NAAAHDAC3HDAC1
SCHEMBL27839050 0.92 NAAA (0.59) EPHX2NAAAEPHX1
SCHEMBL11790864 0.92 NAAA (0.59) EPHX2NAAAEPHX1
SCHEMBL29290660 0.92 NAAA (0.59) EPHX2NAAAEPHX1
SCHEMBL1017033 0.92 NAAA (0.59) EPHX2NAAAEPHX1
SCHEMBL6836287 0.92 NAAA (0.59) EPHX2NAAAEPHX1
SCHEMBL28059682 0.92 NAAA (0.59) EPHX2NAAAEPHX1
SCHEMBL28882747 0.92 NAAA (0.59) EPHX2NAAAEPHX1
SCHEMBL13169083 0.90 EPHX1 (0.54) EPHX2SMN1; SMN2NAAAEPHX1
SCHEMBL2998396 0.90 EPHX1 (0.44) EPHX2SMN1; SMN2EPHX1ALDH1A1

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-115161095-B High-speed bearing lubricating grease composition and preparation method thereof 中国石油化工股份有限公司 2023-08-25 CN disclosed
CN-115161095-A High-speed bearing lubricating grease composition and preparation method thereof 中国石油化工股份有限公司 2022-10-11 CN disclosed