SCHEMBL10280341

SCHEMBL10280341

C[C@H](PNBO)[C@H]1O[C@@H](n2ccc(NC(=O)c3ccccc3)nc2=O)[C@H](OC(=O)c2ccccc2)[C@@H]1OC(=O)c1ccccc1

nearest known ligand 0.51

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
POLB P06746 2/20 0.51
P2RY6 Q15077 3/20 0.45
P2RY14 Q15391 2/20 0.45
NT5E P21589 1/20 0.45
ABL1 P00519 1/20 0.45
RIN1 Q13671 1/20 0.45
KMT2A Q03164 3/20 0.35
MEN1 O00255 2/20 0.35
USP2 O75604 1/20 0.35
ST6GAL1 P15907 1/20 0.33
P2RY12 Q9H244 1/20 0.32
MAP3K5 Q99683 1/20 0.32
ALDH1A1 P00352 3/20 0.32
HTT P42858 2/20 0.32
NPC1 O15118 1/20 0.32
LMNA P02545 1/20 0.32
RAB9A P51151 1/20 0.32
SMN1; SMN2 Q16637 1/20 0.32
P2RY4 P51582 1/20 0.32
GAPDH P04406 2/20 0.31

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
SCHEMBL881994 0.85 POLB (0.52) POLBP2RY6P2RY14NT5EABL1
SCHEMBL800189 0.84 POLB (0.54) POLBP2RY6P2RY14NT5EABL1
SCHEMBL881945 0.81 POLB (0.44) POLBKMT2AMEN1USP2P2RY12
SCHEMBL7033257 0.78 POLB (0.68) POLBP2RY6P2RY14NT5EABL1
SCHEMBL14428954 0.76 POLB (0.58) POLBP2RY6P2RY14NT5EABL1
SCHEMBL15691498 0.76 POLB (0.56) POLBP2RY6P2RY14NT5EABL1
SCHEMBL16904883 0.76 POLB (0.57) POLBP2RY6P2RY14NT5EABL1
SCHEMBL12404755 0.76 P2RY6 (0.59) POLBP2RY6P2RY14NT5EABL1
Phosphoric Acid SCHEMBL22498821 0.75 P2RY6 (0.56) POLBP2RY6P2RY14NT5EABL1
SCHEMBL13396551 0.75 POLB (0.64) POLBP2RY6P2RY14NT5EABL1

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-2012040126-A1 SUBSTITUTED NUCLEOTIDE ANALOGS ALIOS BIOPHARMA, INC. (US) 2012-03-29 WO disclosed