SCHEMBL19503295

SCHEMBL19503295

CNc1ncnc2c1ncn2C[C@H]1CC[C@@H](COP(=O)(O)OP(=O)(O)O)C1

nearest known ligand 0.56

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
▸ P2RY1 P47900 5/20 0.53
▸ P2RY2 P41231 1/20 0.51
▸ GPR17 Q13304 1/20 0.45
▸ P2RX3 P56373 3/20 0.43
▸ P2RX2 Q9UBL9 3/20 0.43
▸ P2RX4 Q99571 1/20 0.42
▸ PDE4A P27815 1/20 0.41
▸ PDE4B Q07343 1/20 0.41
▸ PDE4C Q08493 1/20 0.41
▸ PDE4D Q08499 1/20 0.41
▸ YTHDC1 Q96MU7 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
SCHEMBL21257339 0.84 P2RX3 (0.53) P2RY1P2RY2P2RX3P2RX2P2RX4
SCHEMBL21257373 0.78 YTHDC1 (0.62) P2RY1YTHDC1
SCHEMBL19503343 0.77 P2RY1 (0.59) P2RY1P2RY2PDE4APDE4BPDE4C
SCHEMBL19503301 0.76 P2RY1 (0.58) P2RY1P2RY2GPR17P2RX3P2RX2
SCHEMBL24320810 0.75 P2RY1 (0.57) P2RY1P2RY2GPR17P2RX3P2RX2
SCHEMBL1064092 0.74 POLB (0.61) P2RY1P2RY2GPR17P2RX3P2RX2
SCHEMBL29664985 0.74 POLB (0.61) P2RY1P2RY2GPR17P2RX3P2RX2
SCHEMBL3637334 0.74 POLB (0.61) P2RY1P2RY2GPR17P2RX3P2RX2
SCHEMBL15721195 0.74 POLB (0.61) P2RY1P2RY2GPR17P2RX3P2RX2
SCHEMBL25613500 0.72 P2RY1 (0.52) P2RY1P2RY2GPR17P2RX3P2RX4

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-2017185061-A1 COMPOUNDS AND METHODS FOR TREATING NEUROLOGICAL AND CARDIOVASCULAR CONDITIONS ASTROCYTE PHARMACEUTICALS, INC. (US) 2017-10-26 — — WO disclosed
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