SCHEMBL29330554

SCHEMBL29330554

Nc1nc2c(ncn2[C@H]2CC[C@@H](COP(=O)(O)OC3[C@H](n4c(=O)[nH]c5c(N)ncnc54)O[C@H](COP(=O)(O)S)[C@H]3O)O2)c(=O)[nH]1

nearest known ligand 0.48

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
▸ RNASEL Q05823 9/20 0.48
▸ P2RY2 P41231 1/20 0.48
▸ P2RY4 P51582 1/20 0.48
▸ P2RY6 Q15077 1/20 0.48
▸ TGM2 P21980 1/20 0.47
▸ NT5E P21589 1/20 0.47
▸ FUT5 Q11128 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
SCHEMBL22352203 0.91 RNASEL (0.59) RNASEL
SCHEMBL23679562 0.88 RNASEL (0.49) RNASELP2RY2
SCHEMBL23679813 0.88 RNASEL (0.64) RNASEL
SCHEMBL22352078 0.86 RNASEL (0.52) RNASELNT5E
SCHEMBL29330757 0.84 RNASEL (0.53) RNASEL
SCHEMBL22524139 0.84 RNASEL (0.58) RNASEL
SCHEMBL29323926 0.83 RNASEL (0.58) RNASEL
SCHEMBL20324735 0.82 RNASEL (0.62) RNASELP2RY2
SCHEMBL23679596 0.82 P2RY2 (0.49) RNASELP2RY2P2RY4P2RY6NT5E
SCHEMBL22352140 0.81 NT5E (0.49) RNASELP2RY2TGM2NT5EFUT5

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-3854799-B1 CYCLIC DINUCLEOTIDE ANALOGUE, PHARMACEUTICAL COMPOSITION THEREOF, AND APPLICATION SHANGHAI DE NOVO PHARMATECH CO LTD (CN) 2024-07-17 — — EP disclosed
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