SCHEMBL4304767

SCHEMBL4304767

CCCCCCCCOS(=O)OCCCCCCCC

nearest known ligand 0.46

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
EPHX2 P34913 2/20 0.46
CA1 P00915 8/20 0.43
CA2 P00918 8/20 0.43
CA9 Q16790 7/20 0.43
LPAR3 Q9UBY5 3/20 0.43
CA12 O43570 3/20 0.43
CA7 P43166 3/20 0.43
CA14 Q9ULX7 3/20 0.43
LPAR1 Q92633 2/20 0.43
LPAR2 Q9HBW0 2/20 0.43
CA3 P07451 2/20 0.43
CA4 P22748 2/20 0.43
CA6 P23280 2/20 0.43
CA5A P35218 2/20 0.43
CA5B Q9Y2D0 2/20 0.43
NAAA Q02083 1/20 0.43
TSHR P16473 2/20 0.42
THRB P10828 1/20 0.42
RECQL P46063 2/20 0.41
CES2 O00748 1/20 0.41

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
SCHEMBL246738 1.00 EPHX2 (0.46) EPHX2CA1CA2CA9LPAR3
SCHEMBL28431774 1.00 EPHX2 (0.46) EPHX2CA1CA2CA9LPAR3
SCHEMBL28083458 1.00 EPHX2 (0.46) EPHX2CA1CA2CA9LPAR3
SCHEMBL28383874 1.00 EPHX2 (0.46) EPHX2CA1CA2CA9LPAR3
SCHEMBL28888136 1.00 EPHX2 (0.46) EPHX2CA1CA2CA9LPAR3
SCHEMBL778726 1.00 EPHX2 (0.46) EPHX2CA1CA2CA9LPAR3
SCHEMBL9400299 1.00 EPHX2 (0.46) EPHX2CA1CA2CA9LPAR3
SCHEMBL4299797 1.00 EPHX2 (0.46) EPHX2CA1CA2CA9LPAR3
SCHEMBL9129611 1.00 EPHX2 (0.46) EPHX2CA1CA2CA9LPAR3
SCHEMBL16736487 0.97 EPHX2 (0.44) EPHX2CA1CA2CA9LPAR3

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1594943-B1 LUBRICATING OIL COMPOSITIONS SHELL INT RESEARCH (NL) 2019-01-16 EP disclosed
EP-1772924-B1 NONAQUEOUS ELECTROLYTIC SOLUTION AND LITHIUM SECONDARY BATTERY UBE INDUSTRIES (JP) 2013-04-10 EP disclosed
CN-100587048-C Lubricating oil composition Shell int research co ltd 2010-02-03 CN disclosed
US-7629085-B2 sulfur-containing acid ester and an alkyne-containing compound; excellent battery characteristics in cycle performance, electric capacity and storage property; e.g. 2-propynyl methyl carbonate and 1,3-propanesultone UBE INDUSTRIES, LTD. (JP) 2009-12-08 US disclosed
CN-100474688-C Nonaqueous electrolytic solution and lithium secondary battery UBE INDUSTRIES (JP) 2009-04-01 CN disclosed
US-20070231707-A1 Nonaqueous Electrolytic Solution and Lithium Secondary Battery MU IONIC SOLUTIONS CORPORATION (JP) 2007-10-04 US disclosed
CN-1989647-A Nonaqueous electrolytic solution and lithium secondary battery UBE INDUSTRIES (JP) 2007-06-27 CN disclosed
EP-1772924-A1 NONAQUEOUS ELECTROLYTIC SOLUTION AND LITHIUM SECONDARY BATTERY Ube Industries, Ltd. (JP) 2007-04-11 EP disclosed
CN-1751115-A Lubricating oil composiyion SHELL INT RESEARCH (NL) 2006-03-22 CN disclosed
EP-1594943-A2 LUBRICATING OIL COMPOSITIONS SHELL INTERNATIONALE RESEARCHMAATSCHAPPIJ B.V. (NL) 2005-11-16 EP disclosed
US-20040224860-A1 Lubricating oil compositions SHELL OIL COMPANY 2004-11-11 US disclosed
WO-2004074412-A2 LUBRICATING OIL COMPOSITIONS SHELL INTERNATIONALE RESEARCH MAATSCHAPPIJ B.V. (NL) 2004-09-02 WO disclosed