SCHEMBL26567972

SCHEMBL26567972

C[C@H]1OC(n2c[n+](C)c3c(=O)[nH]c(N)nc32)[C@H](O)[C@@H]1CCC#N

nearest known ligand 0.35

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
TLR7 Q9NYK1 6/20 0.35
HINT1 P49773 3/20 0.34
PNP P00491 1/20 0.33
GSK3A P49840 1/20 0.33
RPS6KA3 P51812 1/20 0.33
MAPK14 Q16539 1/20 0.33
NT5E P21589 1/20 0.33
ADK P55263 1/20 0.32
TAAR1 Q96RJ0 1/20 0.32
STING1 Q86WV6 2/20 0.32
PDE3B Q13370 1/20 0.32
PDE3A Q14432 1/20 0.32

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
SCHEMBL26569031 0.89 TLR7 (0.37) TLR7HINT1PNPGSK3ARPS6KA3
SCHEMBL26568527 0.87 PNP (0.40) TLR7HINT1PNPGSK3ARPS6KA3
SCHEMBL26201631 0.86 TLR7 (0.38) TLR7HINT1PNPGSK3ARPS6KA3
SCHEMBL26202558 0.86 TLR7 (0.38) TLR7HINT1PNPGSK3ARPS6KA3
SCHEMBL26567625 0.85 HINT1 (0.38) TLR7HINT1PNPGSK3ARPS6KA3
SCHEMBL26567971 0.85 TLR7 (0.35) TLR7HINT1PNPGSK3ARPS6KA3
SCHEMBL26201881 0.85 HINT1 (0.37) TLR7HINT1PNPGSK3ARPS6KA3
SCHEMBL26202070 0.84 HINT1 (0.39) TLR7HINT1PNPGSK3ARPS6KA3
SCHEMBL26575829 0.84 TLR7 (0.39) TLR7HINT1PNPGSK3ARPS6KA3
SCHEMBL26566855 0.84 HINT1 (0.39) TLR7HINT1PNPGSK3ARPS6KA3

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-4261217-A1 COMPOUND FOR RNA CAPPING AND APPLICATION OF COMPOUND Guangzhou Henovcom Bioscience Co., Ltd. (CN) 2023-10-18 EP disclosed