SCHEMBL6886611

SCHEMBL6886611

O=P(O)(O)OP(=O)(O)OP(=O)(O)OC[C@H]1O[C@@H](c2nc3cc(F)ccc3s2)[C@H](O)[C@@H]1O

nearest known ligand 1.00 ✓ in ChEMBL — recovers established targets

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
▸ P2RY2 P41231 19/20 1.00
▸ P2RY4 P51582 5/20 0.79

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
SCHEMBL6399722 0.94 P2RY2 (0.88) P2RY2P2RY4
SCHEMBL6886614 0.91 P2RY2 (0.83) P2RY2P2RY4
SCHEMBL6395428 0.89 P2RY2 (1.00) P2RY2P2RY4
SCHEMBL6394295 0.88 P2RY2 (1.00) P2RY2P2RY4
SCHEMBL6393343 0.85 P2RY2 (1.00) P2RY2P2RY4
SCHEMBL6400565 0.83 P2RY2 (1.00) P2RY2P2RY4
SCHEMBL6887904 0.81 P2RY2 (1.00) P2RY2P2RY4
SCHEMBL6400276 0.80 P2RY2 (1.00) P2RY2P2RY4
SCHEMBL6395433 0.80 P2RY2 (0.84) P2RY2P2RY4
SCHEMBL26658229 0.78 P2RY2 (0.65) P2RY2P2RY4

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-1409503-A1 NON-NATURAL CARBON-LINKED NUCLEOTIDES AND DINUCLEOTIDES Celltech R & D Limited (GB) 2004-04-21 — — EP claimed
WO-2003011885-A1 NON-NATURAL CARBON-LINKED NUCLEOTIDES AND DINUCLEOTIDES CELLTECH R & D LIMITED (GB) 2003-02-13 — — WO claimed
EP-1409503-A1 NON-NATURAL CARBON-LINKED NUCLEOTIDES AND DINUCLEOTIDES Celltech R & D Limited (GB) 2004-04-21 — — EP disclosed
WO-2003011885-A1 NON-NATURAL CARBON-LINKED NUCLEOTIDES AND DINUCLEOTIDES CELLTECH R & D LIMITED (GB) 2003-02-13 — — WO disclosed
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