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SCHEMBL28567280

SCHEMBL28567280

CC(OC(=O)CCc1cc(C(C)(C)C)c(O)c(C(C)(C)C)c1)SC(C)OC(=O)CCc1cc(C(C)(C)C)c(O)c(C(C)(C)C)c1.CCCCCCCCCCCCCOC(=O)CCc1cc(C(C)(C)C)c(O)c(C(C)(C)C)c1

nearest known ligand 0.44

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
▸ GAA P10253 2/20 0.44
▸ KMT2A Q03164 2/20 0.44
▸ CNR2 P34972 9/20 0.43
▸ CNR1 P21554 8/20 0.43
▸ MEN1 O00255 1/20 0.38
▸ DGKA P23743 1/20 0.38
▸ ESR1 P03372 1/20 0.37
▸ AKR1C4 P17516 1/20 0.37
▸ AKR1C3 P42330 1/20 0.37
▸ AKR1C2 P52895 1/20 0.37
▸ AKR1C1 Q04828 1/20 0.37

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
SCHEMBL283853 0.89 GAA (0.53) GAAKMT2ACNR2CNR1DGKA
SCHEMBL284382 0.89 GAA (0.53) GAAKMT2ACNR2CNR1DGKA
SCHEMBL17491243 0.89 GAA (0.53) GAAKMT2ACNR2CNR1DGKA
SCHEMBL754404 0.89 GAA (0.53) GAAKMT2ACNR2CNR1DGKA
SCHEMBL13899816 0.89 GAA (0.53) GAAKMT2ACNR2CNR1DGKA
SCHEMBL2050437 0.89 GAA (0.53) GAAKMT2ACNR2CNR1DGKA
SCHEMBL25227497 0.89 GAA (0.53) GAAKMT2ACNR2CNR1DGKA
SCHEMBL208070 0.89 GAA (0.53) GAAKMT2ACNR2CNR1DGKA
SCHEMBL284357 0.89 GAA (0.53) GAAKMT2ACNR2CNR1DGKA
Octane SCHEMBL21828749 0.89 GAA (0.53) GAAKMT2ACNR2CNR1DGKA

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 4 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-112912477-B Lubricating oil composition 引能仕株式会社 2022-11-11 — — CN disclosed
CN-112912478-B Lubricating oil composition 引能仕株式会社 2022-11-08 — — CN disclosed
CN-112912478-A Lubricating oil composition 引能仕株式会社 2021-06-04 — — CN disclosed
CN-112912477-A Lubricating oil composition 引能仕株式会社 2021-06-04 — — CN disclosed