SCHEMBL16014028

SCHEMBL16014028

CCS(=O)(=O)OCCOC

nearest known ligand 0.35

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
CA2 P00918 13/20 0.35
CA1 P00915 12/20 0.35
USP2 O75604 2/20 0.33
TSHR P16473 2/20 0.33
KDM4E B2RXH2 1/20 0.32
ALDH1A1 P00352 1/20 0.32
LMNA P02545 1/20 0.32
MMP9 P14780 1/20 0.32
ALOX15 P16050 1/20 0.32
CA9 Q16790 8/20 0.31
CA12 O43570 3/20 0.30
CA7 P43166 3/20 0.30
CA14 Q9ULX7 3/20 0.30
CA3 P07451 2/20 0.30
CA4 P22748 2/20 0.30
CA6 P23280 2/20 0.30
CA5A P35218 2/20 0.30
CA5B Q9Y2D0 2/20 0.30

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
SCHEMBL28407515 0.93 CA2 (0.44) CA2CA1TSHR
SCHEMBL9543126 0.88 CA1 (0.41) CA2CA1USP2TSHRKDM4E
SCHEMBL30164353 0.85 CA1 (0.39) CA2CA1USP2TSHRKDM4E
SCHEMBL25989148 0.84 TSHR (0.46) CA2CA1USP2TSHRKDM4E
SCHEMBL16116335 0.82 CA2 (0.36) CA2CA1TSHRALDH1A1CA9
SCHEMBL30671863 0.80 CA2 (0.35) CA2
SCHEMBL14444719 0.78 USP2 (0.57) CA2CA1USP2TSHRKDM4E
SCHEMBL9647721 0.77 USP2 (0.37) CA2CA1USP2TSHRKDM4E
SCHEMBL776569 0.77
SCHEMBL575454 0.77 TSHR (0.48) CA2CA1USP2TSHRKDM4E

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-102532228-A 2'-O-(2-methoxyethyl)adenosine and 2'-O-(2-methoxyethyl)guanosine, preparation of derivatives thereof and purifying methods thereof HONGENE BIOTECHNOLOGY LTD 2012-07-04 CN claimed
EP-2964635-A1 ANTIVIRAL COMPOUNDS F. Hoffmann-La Roche AG (CH) 2016-01-13 EP disclosed
CN-102532228-B The preparation of 2 '-O-(2-methoxyethyl) adenosine and 2 '-O-(2-methoxyethyl) guanosine and derivative thereof and purification process thereof Hongene Biotechnology Limited (CN) 2016-01-06 CN disclosed
WO-2014135495-A1 ANTIVIRAL COMPOUNDS F. HOFFMANN-LA ROCHE AG (CH) 2014-09-12 WO disclosed
CN-102532228-A 2'-O-(2-methoxyethyl)adenosine and 2'-O-(2-methoxyethyl)guanosine, preparation of derivatives thereof and purifying methods thereof HONGENE BIOTECHNOLOGY LTD 2012-07-04 CN disclosed