SCHEMBL28824008

SCHEMBL28824008

CCCCC(=O)NC(=O)[C@@]1(n2cnc3c(N)ncnc32)O[C@H](CO)[C@@H](O)[C@H]1O

nearest known ligand 0.43

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ ADORA2A P29274 3/20 0.43
▸ AHCY P23526 1/20 0.42
▸ PI4KA P42356 2/20 0.42
▸ PI4K2B Q8TCG2 2/20 0.42
▸ PI4K2A Q9BTU6 2/20 0.42
▸ PI4KB Q9UBF8 2/20 0.42
▸ EHMT1 Q9H9B1 1/20 0.42
▸ ADORA3 P0DMS8 2/20 0.41
▸ GMPS P49915 1/20 0.41
▸ DPP4 P27487 1/20 0.41
▸ MEN1 O00255 1/20 0.41
▸ SLC28A1 O00337 1/20 0.41
▸ MAP3K7 O43318 1/20 0.41
▸ SLC28A2 O43868 1/20 0.41
▸ GAPDH P04406 1/20 0.41
▸ MAPK1 P28482 1/20 0.41
▸ ADORA2B P29275 1/20 0.41
▸ ADORA1 P30542 1/20 0.41
▸ STAT6 P42226 1/20 0.41
▸ KMT2A Q03164 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
SCHEMBL15798672 0.88 ADORA3 (0.45) ADORA2AAHCYPI4KAPI4K2BPI4K2A
SCHEMBL7226462 0.85 ADORA3 (0.51) ADORA2API4KAPI4K2BPI4K2API4KB
SCHEMBL5561914 0.85 EHMT1 (0.46) ADORA2API4KAPI4K2BPI4K2API4KB
SCHEMBL27945755 0.85 EHMT1 (0.46) ADORA2API4KAPI4K2BPI4K2API4KB
SCHEMBL18011010 0.84 SETD2 (0.44) ADORA2API4KAPI4K2BPI4K2API4KB
SCHEMBL18011012 0.84 SETD2 (0.44) ADORA2API4KAPI4K2BPI4K2API4KB
SCHEMBL6536153 0.84 PI4KA (0.46) ADORA2AAHCYPI4KAPI4K2BPI4K2A
SCHEMBL1300400 0.83 ADORA2A (0.41) ADORA2AAHCYPI4KAPI4K2BPI4K2A
SCHEMBL157247 0.83 ADORA2A (0.41) ADORA2AAHCYPI4KAPI4K2BPI4K2A
SCHEMBL1275036 0.82 TARS1 (0.46) ADORA2AAHCYPI4KAPI4K2BPI4K2A

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
CN-114929288-A Synthetic modified RNA and uses thereof 西奈山伊坎医学院 2022-08-19 — — CN disclosed
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