SCHEMBL27434392

SCHEMBL27434392

C[C@H]1O[C@@H](n2cnc3c(OCc4ccc(-c5ccncc5)cc4)ncnc32)[C@H](O)[C@@H]1O

nearest known ligand 0.59

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
▸ SLC29A1 Q99808 4/20 0.59
▸ ADORA3 P0DMS8 2/20 0.52
▸ AHCY P23526 2/20 0.42
▸ DNPH1 O43598 1/20 0.42
▸ AMD1 P17707 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
SCHEMBL27425390 0.87 SLC29A1 (0.62) SLC29A1ADORA3
SCHEMBL27426560 0.87 SLC29A1 (0.62) SLC29A1ADORA3AHCY
SCHEMBL27426665 0.86 SLC29A1 (0.59) SLC29A1ADORA3AHCY
SCHEMBL27427947 0.86 SLC29A1 (0.61) SLC29A1ADORA3
SCHEMBL27435478 0.85 SLC29A1 (0.55) SLC29A1ADORA3AHCYDNPH1
SCHEMBL27432155 0.85 SLC29A1 (0.55) SLC29A1ADORA3AHCYAMD1
SCHEMBL27425126 0.85 SLC29A1 (0.59) SLC29A1ADORA3AHCY
SCHEMBL27426759 0.85 SLC29A1 (0.59) SLC29A1ADORA3AHCY
SCHEMBL27428648 0.85 SLC29A1 (0.59) SLC29A1ADORA3AHCY
SCHEMBL27432081 0.84 SLC29A1 (0.56) SLC29A1ADORA3AHCY

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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