SCHEMBL29862897

SCHEMBL29862897

Cc1cn([C@]2(C)O[C@H](COP(=O)(O)OP(=O)(O)OP(=O)(O)O)[C@@H](O)[C@H]2O)c(=O)nc1N

nearest known ligand 0.51

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
P2RY2 P41231 9/20 0.45
POLG P54098 1/20 0.44
P2RX1 P51575 2/20 0.43
P2RX3 P56373 2/20 0.43
P2RX4 Q99571 2/20 0.43
P2RY6 Q15077 3/20 0.42
ENPP1 P22413 1/20 0.42
P2RY1 P47900 1/20 0.42
P2RY11 Q96G91 1/20 0.42
RNASEL Q05823 1/20 0.41
P2RY4 P51582 4/20 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
SCHEMBL18394211 0.84 P2RY2 (0.51) P2RY2POLGP2RX1P2RX3P2RX4
SCHEMBL5409945 0.81 POLB (0.51) P2RY2P2RY6P2RY4
SCHEMBL25243184 0.81 ADSS2 (0.40) P2RY2P2RY6P2RY1P2RY11P2RY4
SCHEMBL1684840 0.79 DNMT1 (0.34)
SCHEMBL31309815 0.78 P2RY2 (0.42) P2RY2POLGP2RX1P2RX3P2RX4
SCHEMBL17210998 0.77 P2RY2 (0.68) P2RY2P2RX1P2RX3P2RX4P2RY6
SCHEMBL667969 0.77 P2RY2 (0.68) P2RY2P2RX1P2RX3P2RX4P2RY6
SCHEMBL18609299 0.77 P2RY2 (0.68) P2RY2P2RX1P2RX3P2RX4P2RY6
SCHEMBL16805401 0.77 P2RY2 (0.68) P2RY2P2RX1P2RX3P2RX4P2RY6
SCHEMBL624932 0.77 P2RY2 (0.68) P2RY2P2RX1P2RX3P2RX4P2RY6

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
CN-114901360-A Novel lipid nanoparticles for delivery of nucleic acids 库瑞瓦格股份公司 2022-08-12 CN disclosed