SCHEMBL27435474

SCHEMBL27435474

COc1cc(COc2ncnc3c2ncn3[C@@H]2O[C@H](C)[C@@H](O)[C@H]2O)cc(OC)c1OC

nearest known ligand 0.54

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
▸ SLC29A1 Q99808 2/20 0.54
▸ ADORA2A P29274 4/20 0.53
▸ ADORA2B P29275 3/20 0.53
▸ ADORA3 P0DMS8 4/20 0.52
▸ ADORA1 P30542 4/20 0.46

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
SCHEMBL27427202 0.85 SLC29A1 (0.56) SLC29A1ADORA2AADORA3ADORA1
SCHEMBL27426410 0.84 SLC29A1 (0.56) SLC29A1ADORA2AADORA2BADORA3ADORA1
SCHEMBL27427947 0.84 SLC29A1 (0.61) SLC29A1ADORA2AADORA2BADORA3ADORA1
SCHEMBL27427944 0.83 SLC29A1 (0.51) SLC29A1ADORA2AADORA2BADORA3ADORA1
SCHEMBL27433530 0.83 SLC29A1 (0.49) SLC29A1ADORA2AADORA2BADORA3ADORA1
SCHEMBL27425390 0.81 SLC29A1 (0.62) SLC29A1ADORA2AADORA2BADORA3ADORA1
SCHEMBL27426560 0.81 SLC29A1 (0.62) SLC29A1ADORA2AADORA2BADORA3ADORA1
SCHEMBL27427694 0.81 SLC29A1 (0.56) SLC29A1ADORA3
SCHEMBL27426411 0.81 SLC29A1 (0.56) SLC29A1ADORA2AADORA2BADORA3ADORA1
SCHEMBL27433250 0.79 ADORA3 (0.54) SLC29A1ADORA2AADORA2BADORA3ADORA1

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-2024134541-A1 HETEROCYCLIC COMPOUNDS AS ENT INHIBITORS AND COMPOUNDS FOR USE IN THE TREATMENT OF CANCERS iTeos Belgium SA (BE) 2024-06-27 — — WO disclosed
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