SCHEMBL9693060

SCHEMBL9693060

NCCCCCCNc1ncnc2c1ncn2[C@H]1C[C@H](O)[C@@H](COP(=O)(O)O)O1

nearest known ligand 0.56

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
POLB P06746 1/20 0.56
ENPP1 P22413 3/20 0.53
P2RY1 P47900 1/20 0.53
TAS1R3 Q7RTX0 1/20 0.52
TAS1R1 Q7RTX1 1/20 0.52
P2RX3 P56373 1/20 0.52
P2RX2 Q9UBL9 1/20 0.52
DNPH1 O43598 2/20 0.51
SLC29A1 Q99808 1/20 0.48
P2RY12 Q9H244 1/20 0.47

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
SCHEMBL9184520 0.93 P2RX3 (0.62) POLBENPP1P2RY1P2RX3P2RX2
SCHEMBL29450536 0.93 P2RX3 (0.62) POLBENPP1P2RY1P2RX3P2RX2
SCHEMBL15794921 0.92 P2RX3 (0.63) POLBENPP1P2RY1P2RX3P2RX2
SCHEMBL19699286 0.89 POLB (0.53) POLBENPP1P2RY1TAS1R3TAS1R1
SCHEMBL30888440 0.89 POLB (0.51) POLBENPP1P2RY1TAS1R3TAS1R1
SCHEMBL14399998 0.88 P2RX3 (0.48) POLBENPP1P2RY1TAS1R3TAS1R1
SCHEMBL7060363 0.87 SLC29A1 (0.59) SLC29A1
SCHEMBL19699271 0.86 POLB (0.52) POLBENPP1P2RY1TAS1R3TAS1R1
SCHEMBL216645 0.85 P2RX3 (0.70) P2RY1TAS1R3TAS1R1P2RX3P2RX2
SCHEMBL1042589 0.85 POLB (0.54) POLBENPP1P2RY1TAS1R3TAS1R1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0203959-B1 NUCLEOTIDE ANALOGS FOR NUCLEIC ACID LABELING AND DETECTION LIFE TECHNOLOGIES, INC. (US) 1992-09-09 EP disclosed
EP-0203959-A4 NUCLEOTIDE ANALOGS FOR NUCLEIC ACID LABELING AND DETECTION. LIFE TECHNOLOGIES INC (US) 1989-08-09 EP disclosed
EP-0203959-A1 NUCLEOTIDE ANALOGS FOR NUCLEIC ACID LABELING AND DETECTION. LIFE TECHNOLOGIES INC (US) 1986-12-10 EP disclosed
WO-1986002929-A1 NUCLEOTIDE ANALOGS FOR NUCLEIC ACID LABELING AND DETECTION LIFE TECHNOLOGIES, INC. (US) 1986-05-22 WO disclosed