SCHEMBL3985129

SCHEMBL3985129

O=C(OC[C@@]1(F)O[C@@H](n2cc(F)c(=O)[nH]c2=O)[C@H](OC(=O)c2ccccc2)[C@@H]1OC(=O)c1ccccc1)c1ccccc1

nearest known ligand 0.39

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ MEN1 O00255 1/20 0.39
▸ USP2 O75604 1/20 0.39
▸ POLB P06746 1/20 0.39
▸ KMT2A Q03164 1/20 0.39
▸ RNASE1 P07998 1/20 0.38
▸ MAPT P10636 2/20 0.36
▸ LMNA P02545 2/20 0.36
▸ SMN1; SMN2 Q16637 2/20 0.36
▸ TSHR P16473 1/20 0.36
▸ PMP22 Q01453 1/20 0.36
▸ HBB P68871 1/20 0.36
▸ P2RY6 Q15077 2/20 0.35
▸ P2RY14 Q15391 2/20 0.35
▸ NT5E P21589 1/20 0.35
▸ TK1 P04183 1/20 0.35
▸ HSP90AA1 P07900 1/20 0.35
▸ GAPDH P04406 1/20 0.33
▸ TYMS P04818 1/20 0.33
▸ TK2 O00142 1/20 0.32
▸ ALDH1A1 P00352 1/20 0.32

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
SCHEMBL25403682 0.87 MEN1 (0.37) MEN1USP2POLBKMT2ARNASE1
SCHEMBL13844473 0.78 PDE4D (0.39) MEN1USP2POLBKMT2AMAPT
SCHEMBL7942376 0.77 MEN1 (0.61) MEN1USP2POLBKMT2ARNASE1
SCHEMBL9002093 0.77 MEN1 (0.61) MEN1USP2POLBKMT2ARNASE1
SCHEMBL20983914 0.77 MEN1 (0.61) MEN1USP2POLBKMT2ARNASE1
SCHEMBL5080725 0.77 MEN1 (0.61) MEN1USP2POLBKMT2ARNASE1
SCHEMBL9002102 0.77 MEN1 (0.61) MEN1USP2POLBKMT2ARNASE1
SCHEMBL15841051 0.77 POLB (0.43) MEN1USP2POLBKMT2ARNASE1
SCHEMBL16644423 0.77 POLB (0.40) MEN1USP2POLBKMT2ARNASE1
SCHEMBL15841050 0.77 POLB (0.42) MEN1USP2POLBKMT2ARNASE1

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
WO-2009058800-A2 SYNTHESIS OF NUCLEOSIDES PRESIDENT AND FELLOWS OF HARVARD COLLEGE (US) 2009-05-07 — — WO disclosed
WO-2009058800-A2 SYNTHESIS OF NUCLEOSIDES PRESIDENT AND FELLOWS OF HARVARD COLLEGE (US) 2009-05-07 — — WO disclosed
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