SCHEMBL30869075

SCHEMBL30869075

CC(C)(C)OC(=O)NCCCCOCCNc1cc(B2OC(C)(C)C(C)(C)O2)cc2c1nnn2C1CCCCO1

nearest known ligand 0.40

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
▸ ATR Q13535 4/20 0.40
▸ PRMT5 O14744 1/20 0.34
▸ WDR77 Q9BQA1 1/20 0.34
▸ BRD4 O60885 9/20 0.34
▸ USP30 Q70CQ3 1/20 0.32
▸ TLR2 O60603 1/20 0.31
▸ TLR1 Q15399 1/20 0.31
▸ HRH3 Q9Y5N1 1/20 0.31
▸ MIF P14174 1/20 0.31
▸ ATRIP Q8WXE1 1/20 0.31

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
SCHEMBL27376667 0.89 ATR (0.41) ATRPRMT5WDR77BRD4USP30
SCHEMBL30797747 0.89 ATR (0.41) ATRPRMT5WDR77BRD4USP30
SCHEMBL30869132 0.89 ATR (0.44) ATRPRMT5WDR77BRD4USP30
SCHEMBL30869065 0.86 ATR (0.42) ATRBRD4TLR2TLR1ATRIP
SCHEMBL30869111 0.83 ATR (0.41) ATRBRD4TLR2TLR1ATRIP
SCHEMBL30869064 0.81 ATR (0.41) ATRBRD4TLR2TLR1MIF
SCHEMBL30868992 0.81 ATR (0.42) ATRBRD4TLR2TLR1MIF
SCHEMBL30797881 0.81 ATR (0.47) ATRPRMT5WDR77BRD4USP30
SCHEMBL30869047 0.79 ATR (0.33) ATRPRMT5WDR77USP30
SCHEMBL30869097 0.75 ATR (0.47) ATRBRD4ATRIP

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 2 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-4584249-A1 NOVEL COMPOUNDS AS CK2 INHIBITORS Cambridge Enterprise Limited (GB) 2025-07-16 — — EP disclosed
WO-2024052702-A1 NOVEL COMPOUNDS AS CK2 INHIBITORS CAMBRIDGE ENTERPRISE LIMITED (GB) 2024-03-14 — — WO disclosed
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