SCHEMBL28662239

SCHEMBL28662239

CC(O)C(N)C(=O)N(C)c1ncnc2c1ncn2[C@]1(C=O)O[C@H](CO)[C@@H](O)[C@H]1O

nearest known ligand 0.39

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
▸ ADORA2A P29274 1/20 0.38
▸ ADORA2B P29275 1/20 0.38
▸ NPEPPS P55786 8/20 0.37
▸ ANPEP P15144 8/20 0.37
▸ SMN1; SMN2 Q16637 3/20 0.35
▸ TP53 P04637 2/20 0.35
▸ CYP3A4 P08684 2/20 0.35
▸ PI4KA P42356 1/20 0.35
▸ PI4K2B Q8TCG2 1/20 0.35
▸ PI4K2A Q9BTU6 1/20 0.35
▸ PI4KB Q9UBF8 1/20 0.35
▸ LMNA P02545 1/20 0.35
▸ HIF1A Q16665 1/20 0.35
▸ HTT P42858 1/20 0.35
▸ NPC1 O15118 1/20 0.35
▸ RAB9A P51151 1/20 0.35
▸ PAX8 Q06710 1/20 0.35
▸ SLC29A1 Q99808 1/20 0.35

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
SCHEMBL29835052 0.85 ADORA2A (0.38) ADORA2AADORA2BNPEPPSANPEPSMN1; SMN2
SCHEMBL26981136 0.85 ADORA2A (0.38) ADORA2AADORA2BNPEPPSANPEPSMN1; SMN2
SCHEMBL30950292 0.83 TARS1 (0.37) SLC29A1
SCHEMBL29401884 0.78 ADORA3 (0.53) ADORA2AADORA2BSMN1; SMN2PI4KAPI4K2B
SCHEMBL3831039 0.78 ADORA3 (0.53) ADORA2AADORA2BSMN1; SMN2PI4KAPI4K2B
SCHEMBL31228871 0.77 NPEPPS (0.35) ADORA2AADORA2BNPEPPSANPEPSMN1; SMN2
SCHEMBL29089559 0.76 ADORA2A (0.64) ADORA2AADORA2BNPEPPSSMN1; SMN2PI4KA
SCHEMBL29089554 0.76 ADORA2A (0.64) ADORA2AADORA2BNPEPPSSMN1; SMN2PI4KA
SCHEMBL30968983 0.74 RXFP1 (0.39) ADORA2AADORA2BTP53LMNAHTT
SCHEMBL29238711 0.73 HTR2B (0.34) —

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-113840926-A Method for preparing lipid-encapsulated RNA nanoparticles 阿克丘勒斯治疗公司 2021-12-24 — — CN disclosed
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