SCHEMBL30633338

SCHEMBL30633338

CC(C)CCNC(=O)c1cc2c(-c3ccc4[nH]nc(N)c4c3)ccnc2[nH]1

nearest known ligand 0.48

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
▸ NUDT1 P36639 5/20 0.48
▸ DYRK1A Q13627 8/20 0.44
▸ CCNK O75909 3/20 0.44
▸ CDK12 Q9NYV4 3/20 0.44
▸ JAK2 O60674 1/20 0.41
▸ WNT1 P04628 3/20 0.41
▸ CLK2 P49760 2/20 0.41
▸ CLK3 P49761 2/20 0.41
▸ ALPL P05186 1/20 0.41
▸ TBK1 Q9UHD2 1/20 0.40
▸ CIT O14578 1/20 0.40
▸ GSK3B P49841 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
SCHEMBL26685806 1.00 NUDT1 (0.48) NUDT1DYRK1ACCNKCDK12JAK2
SCHEMBL31240736 0.89 NUDT1 (0.49) NUDT1DYRK1ACCNKCDK12JAK2
SCHEMBL26685908 0.89 NUDT1 (0.49) NUDT1DYRK1ACCNKCDK12JAK2
SCHEMBL30633154 0.88 NUDT1 (0.46) NUDT1DYRK1ACCNKCDK12JAK2
SCHEMBL26686470 0.88 NUDT1 (0.46) NUDT1DYRK1ACCNKCDK12JAK2
SCHEMBL31240633 0.88 CCNK (0.54) NUDT1DYRK1ACCNKCDK12JAK2
SCHEMBL26686484 0.88 CCNK (0.54) NUDT1DYRK1ACCNKCDK12JAK2
SCHEMBL30633128 0.87 CCNK (0.55) NUDT1DYRK1ACCNKCDK12JAK2
SCHEMBL26686576 0.87 CCNK (0.55) NUDT1DYRK1ACCNKCDK12JAK2
SCHEMBL30633157 0.85 CHUK (0.56) NUDT1DYRK1ACCNKCDK12WNT1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-4705291-A1 IKK-ALPHA INHIBITORS Cancer Research Technology Limited (GB) 2026-03-11 — — EP claimed
CN-119562945-A IKK inhibitors 癌症研究技术有限公司 2025-03-04 — — CN claimed
WO-2024228035-A1 IKK-ALPHA INHIBITORS CANCER RESEARCH TECHNOLOGY LIMITED (GB) 2024-11-07 — — WO claimed
EP-4705291-A1 IKK-ALPHA INHIBITORS Cancer Research Technology Limited (GB) 2026-03-11 — — EP disclosed
EP-4522597-A1 IKK INHIBITORS Cancer Research Technology Limited (GB) 2025-03-19 — — EP disclosed
CN-119562945-A IKK inhibitors 癌症研究技术有限公司 2025-03-04 — — CN disclosed
WO-2024228035-A1 IKK-ALPHA INHIBITORS CANCER RESEARCH TECHNOLOGY LIMITED (GB) 2024-11-07 — — WO disclosed
WO-2023218201-A1 IKK INHIBITORS CANCER RESEARCH TECHNOLOGY LIMITED (GB) 2023-11-16 — — WO disclosed
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