SCHEMBL21133136

SCHEMBL21133136

CN1C=Nc2c(ncn2[C@H]2C[C@@H](F)[C@@H](COP(=O)(O)O[C@H]3[C@@H](F)[C@H](n4cnc5c(=O)[nH]cnc54)O[C@@H]3COP(=O)(O)O)O2)C1N

nearest known ligand 0.46

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
▸ P2RX3 P56373 1/20 0.46
▸ RNASEL Q05823 13/20 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
SCHEMBL21132963 0.84 RNASEL (0.58) RNASEL
SCHEMBL21132968 0.81 P2RX3 (0.41) P2RX3
SCHEMBL21417489 0.78 P2RX3 (0.55) P2RX3RNASEL
SCHEMBL21132767 0.77 P2RX3 (0.56) P2RX3
SCHEMBL21133330 0.77 RNASEL (0.65) RNASEL
SCHEMBL21133320 0.76 P2RX3 (0.56) P2RX3RNASEL
SCHEMBL22399236 0.72 P2RX3 (0.71) P2RX3
SCHEMBL21133316 0.71 P2RX3 (0.56) P2RX3
SCHEMBL21133338 0.71 P2RX3 (0.56) P2RX3
SCHEMBL17860558 0.70 P2RX3 (0.50) P2RX3RNASEL

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
EP-3505527-A1 CYCLIC DINUCLEOTIDES FOR CYTOKINE INDUCTION Invivogen (FR) 2019-07-03 — — EP disclosed
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