SCHEMBL888149

SCHEMBL888149

COc1ccc(COC[C@H]2O[C@@H](n3cnc4c(N)ncnc43)C[C@@H]2OP(=O)(O)OP(=O)(O)OP(=O)(O)O)c([N+](=O)[O-])c1

nearest known ligand 0.55

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
POLB P06746 1/20 0.45
P2RX1 P51575 4/20 0.43
P2RX3 P56373 4/20 0.43
P2RX2 Q9UBL9 3/20 0.43
P2RX4 Q99571 3/20 0.43
ENPP1 P22413 2/20 0.43
P2RY1 P47900 1/20 0.43
RNASEL Q05823 1/20 0.42
MEN1 O00255 1/20 0.41
ALDH1A1 P00352 1/20 0.41
MAPT P10636 1/20 0.41
HPGD P15428 1/20 0.41
KMT2A Q03164 1/20 0.41
P2RY2 P41231 1/20 0.41

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
SCHEMBL888156 0.89 POLB (0.48) POLBP2RX1P2RX3P2RX2P2RX4
SCHEMBL888142 0.88 POLB (0.44) POLBP2RX1P2RX3P2RX2P2RX4
SCHEMBL888099 0.86 ENPP1 (0.52) POLBENPP1P2RY1
SCHEMBL1140532 0.80 P2RY12 (0.54) POLBP2RX1P2RX3P2RX2P2RX4
SCHEMBL888084 0.80 POLB (0.47) POLBP2RX1P2RX3P2RX2P2RX4
SCHEMBL14665951 0.78 P2RX3 (0.53) POLBP2RX1P2RX3P2RX2P2RX4
SCHEMBL30848930 0.78 P2RX3 (0.53) POLBP2RX1P2RX3P2RX2P2RX4
SCHEMBL888262 0.78 P2RX3 (0.53) POLBP2RX1P2RX3P2RX2P2RX4
SCHEMBL21564046 0.78 P2RX3 (0.53) POLBP2RX1P2RX3P2RX2P2RX4
SCHEMBL888089 0.78 P2RX3 (0.53) POLBP2RX1P2RX3P2RX2P2RX4

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
US-20110287427-A1 3'OH-UNBLOCKED, NUCLEOTIDES AND NUCLEOSIDES BASE MODIFIED WITH LABELS AND PHOTOCLEAVABLE, TERMINATING GROUPS AND METHODS FOR THEIR USE IN DNA SEQUENCING LASERGEN, INC. (US) 2011-11-24 US disclosed
US-7964352-B2 3′-OH unblocked nucleotides and nucleosides, base modified with labels and photocleavable, terminating groups and methods for their use in DNA sequencing LASERGEN, INC. (US) 2011-06-21 US disclosed
US-7897737-B2 Polymorphic identification; fluorescent dyes LASERGEN, INC. (US) 2011-03-01 US disclosed