SCHEMBL13615887

SCHEMBL13615887

CO[C@H]1C(n2ccc(NC(=O)c3ccccc3)nc2=O)O[C@@](CO[Si](c2ccccc2)(c2ccccc2)C(C)(C)C)(C(C)C)[C@H]1O

nearest known ligand 0.45

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
P2RY6 Q15077 5/20 0.43
P2RY14 Q15391 2/20 0.43
NT5E P21589 1/20 0.43
ABL1 P00519 1/20 0.41
RIN1 Q13671 1/20 0.41
POLB P06746 1/20 0.40
CYP3A4 P08684 1/20 0.33
ST6GAL1 P15907 1/20 0.32
KMT2A Q03164 2/20 0.32
ALDH1A1 P00352 1/20 0.32
MAPT P10636 1/20 0.32
HTT P42858 1/20 0.32
P2RY2 P41231 3/20 0.32
P2RY4 P51582 3/20 0.32
SMYD2 Q9NRG4 1/20 0.31
MEN1 O00255 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
SCHEMBL13615885 0.85 P2RY6 (0.49) P2RY6P2RY14NT5EABL1RIN1
SCHEMBL13615620 0.80 PRMT6 (0.41)
SCHEMBL13616330 0.80 DUT (0.36) P2RY6P2RY14NT5EP2RY2P2RY4
SCHEMBL13615609 0.76 TK1 (0.36) POLBALDH1A1
SCHEMBL13607352 0.76 P2RY6 (0.44) P2RY6P2RY14NT5EABL1RIN1
SCHEMBL13607348 0.74 P2RY6 (0.38) P2RY6P2RY14NT5EABL1RIN1
SCHEMBL13026857 0.73 P2RY6 (0.47) P2RY6P2RY14NT5EABL1RIN1
SCHEMBL13026832 0.73 P2RY6 (0.47) P2RY6P2RY14NT5EABL1RIN1
SCHEMBL14416939 0.73 P2RY6 (0.49) P2RY6P2RY14NT5EABL1RIN1
SCHEMBL14396973 0.73 P2RY6 (0.49) P2RY6P2RY14NT5EABL1RIN1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2009143369-A2 METHOD OF PREPARING NUCLEOSIDES AND ANALOGS THEREOF WITHOUT USING CHROMATOGRAPHY ISIS PHARMACEUTICALS, INC. (US) 2009-11-26 WO disclosed