SCHEMBL27776652

SCHEMBL27776652

[2H]P(=O)(O)ON1CCOCC1

nearest known ligand 0.34

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
▸ L3MBTL1 Q9Y468 1/20 0.32
▸ CA12 O43570 2/20 0.31
▸ SMN1; SMN2 Q16637 1/20 0.31
▸ CA1 P00915 1/20 0.31
▸ CA9 Q16790 1/20 0.31
▸ TSHR P16473 1/20 0.31
▸ MEN1 O00255 1/20 0.30
▸ TP53 P04637 1/20 0.30
▸ KMT2A Q03164 1/20 0.30
▸ CA7 P43166 1/20 0.30
▸ CA14 Q9ULX7 1/20 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
SCHEMBL4921168 0.82 L3MBTL1 (0.34) L3MBTL1CA12SMN1; SMN2CA1CA9
SCHEMBL15571536 0.80 L3MBTL1 (0.33) L3MBTL1CA12SMN1; SMN2CA1CA9
SCHEMBL15572885 0.80 L3MBTL1 (0.33) L3MBTL1CA12SMN1; SMN2CA1CA9
SCHEMBL15570949 0.80 L3MBTL1 (0.33) L3MBTL1CA12SMN1; SMN2CA1CA9
SCHEMBL15572514 0.80 L3MBTL1 (0.33) L3MBTL1CA12SMN1; SMN2CA1CA9
SCHEMBL4921164 0.77 CA12 (0.35) L3MBTL1CA12SMN1; SMN2CA1CA9
Hydrochloric Acid SCHEMBL15511220 0.75 CA12 (0.33) L3MBTL1CA12SMN1; SMN2CA1CA9
Bromide SCHEMBL15510433 0.75 CA12 (0.33) L3MBTL1CA12SMN1; SMN2CA1CA9
SCHEMBL5963920 0.70 ALDH1A1 (0.32) CA12SMN1; SMN2TSHRCA7CA14
SCHEMBL11022467 0.69 SMN1; SMN2 (0.34) SMN1; SMN2TSHRKMT2A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-102083846-A Synthesis and compositions of nucleic acids comprising 2'-terminator nucleotides ROCHE DIAGNOSTICS GMBH 2011-06-01 — — CN disclosed
CN-101528945-A 2' -terminator-related pyrophosphorolysis-activated polymerization ROCHE DIAGNOSTICS GMBH (CH) 2009-09-09 — — CN disclosed
CN-101506375-A Reversible terminator nucleotides and methods of use APPLERA CORP (US) 2009-08-12 — — CN disclosed
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