SCHEMBL29137662

SCHEMBL29137662

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

nearest known ligand 0.51

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
▸ SLC29A1 Q99808 2/20 0.42
▸ ADORA1 P30542 3/20 0.40
▸ ADORA2A P29274 1/20 0.39
▸ ADORA2B P29275 1/20 0.39
▸ ADORA3 P0DMS8 3/20 0.39
▸ PRMT5 O14744 1/20 0.39
▸ WDR77 Q9BQA1 1/20 0.39

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
SCHEMBL28475028 0.88 SLC29A1 (0.46) SLC29A1ADORA1ADORA2AADORA2BADORA3
SCHEMBL219553 0.85 ADORA3 (0.49) SLC29A1ADORA1ADORA2AADORA2BADORA3
SCHEMBL17627818 0.83 RXFP1 (0.39) SLC29A1ADORA1ADORA2AADORA2BADORA3
SCHEMBL30705001 0.83 RXFP1 (0.39) SLC29A1ADORA1ADORA2AADORA2BADORA3
SCHEMBL27455665 0.83 PI4KA (0.39) SLC29A1ADORA1ADORA2AADORA2BADORA3
SCHEMBL29435121 0.82 TARS1 (0.38) SLC29A1ADORA1
SCHEMBL16987222 0.82 TARS1 (0.38) SLC29A1ADORA1
SCHEMBL28564130 0.82 TARS1 (0.38) SLC29A1ADORA1
Phosphoric Acid SCHEMBL474409 0.81 ADORA1 (0.48) SLC29A1ADORA1ADORA2AADORA2BADORA3
Acetaldehyde SCHEMBL27678170 0.81 ADORA3 (0.48) SLC29A1ADORA1ADORA2AADORA2BADORA3

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-109563127-B Compounds, agents and uses thereof 麦特博隆股份有限公司 2024-01-05 — — CN disclosed
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