SCHEMBL30633151

SCHEMBL30633151

CC(C)(C)C#Cc1cc(-c2ccnc3[nH]c(C(C)(C)O)cc23)cc2c(N)n[nH]c12

nearest known ligand 0.37

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
▸ CHUK O15111 7/20 0.37
▸ IKBKB O14920 6/20 0.37
▸ CIT O14578 1/20 0.33
▸ TBK1 Q9UHD2 4/20 0.33
▸ CLK2 P49760 3/20 0.33
▸ DYRK1A Q13627 3/20 0.33
▸ CLK3 P49761 2/20 0.32
▸ JAK2 O60674 2/20 0.31
▸ CCNK O75909 1/20 0.30
▸ CDK12 Q9NYV4 1/20 0.30
▸ KDM5A P29375 1/20 0.30
▸ KDM5B Q9UGL1 1/20 0.30
▸ INSR P06213 1/20 0.30
▸ MAPK8 P45983 1/20 0.30
▸ CAMKK2 Q96RR4 1/20 0.30
▸ NUDT1 P36639 1/20 0.30

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
SCHEMBL26685805 1.00 CHUK (0.37) CHUKIKBKBCITTBK1CLK2
SCHEMBL26686177 0.92 IKBKB (0.42) CHUKIKBKBCITTBK1CLK2
SCHEMBL26685815 0.86 NUDT1 (0.44) CHUKIKBKBCITCLK2DYRK1A
SCHEMBL30633136 0.86 NUDT1 (0.44) CHUKIKBKBCITCLK2DYRK1A
SCHEMBL26686416 0.83 NUDT1 (0.38) CHUKTBK1CLK2DYRK1ACLK3
SCHEMBL30633155 0.83 NUDT1 (0.38) CHUKTBK1CLK2DYRK1ACLK3
SCHEMBL26686016 0.83 IKBKB (0.44) CHUKIKBKBCITTBK1
SCHEMBL31420163 0.82 BRD4 (0.43) CHUKIKBKBCITCLK2DYRK1A
SCHEMBL26686186 0.82 BRD4 (0.43) CHUKIKBKBCITCLK2DYRK1A
SCHEMBL26686245 0.81 CDK9 (0.42) CHUKIKBKBCITTBK1

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

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