SCHEMBL31725331

SCHEMBL31725331

CC(C)C(=O)OC[C@@]1(F)O[C@@H](n2cnc3c(N)ncnc32)[C@H](O)[C@@H]1F

nearest known ligand 0.53

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
▸ AHCY P23526 10/20 0.53
▸ HSP90B1 P14625 2/20 0.51
▸ ADORA2B P29275 3/20 0.48
▸ ADORA3 P0DMS8 2/20 0.48
▸ PRMT5 O14744 1/20 0.48
▸ WDR77 Q9BQA1 1/20 0.48
▸ HIF1A Q16665 1/20 0.47
▸ TMEM97 Q5BJF2 1/20 0.47
▸ SIGMAR1 Q99720 1/20 0.47
▸ ADORA2A P29274 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
SCHEMBL31725329 0.82 PRMT5 (0.48) AHCYADORA2BADORA3PRMT5WDR77
SCHEMBL25388043 0.82 ADORA3 (0.57) AHCYADORA2BADORA3PRMT5WDR77
SCHEMBL26239618 0.82 ADORA3 (0.57) AHCYADORA2BADORA3PRMT5WDR77
SCHEMBL25390968 0.82 ADORA3 (0.57) AHCYADORA2BADORA3PRMT5WDR77
SCHEMBL25556585 0.81 AHCY (0.44) AHCYHSP90B1
SCHEMBL3978671 0.78 PRMT5 (0.54) AHCYHSP90B1ADORA2BADORA3PRMT5
SCHEMBL3978681 0.78 PRMT5 (0.54) AHCYHSP90B1ADORA2BADORA3PRMT5
SCHEMBL3980534 0.78 PRMT5 (0.54) AHCYHSP90B1ADORA2BADORA3PRMT5
SCHEMBL29712359 0.78 PRMT5 (0.54) AHCYHSP90B1ADORA2BADORA3PRMT5
SCHEMBL31228195 0.77 PRMT5 (0.48) PRMT5WDR77

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
WO-2025235664-A1 PURINE NUCLEOTIDE AND NUCLEOSIDE THERAPEUTIC COMPOSITIONS AND USES RELATED THERETO EMORY UNIVERSITY (US) 2025-11-13 — — WO disclosed
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