SCHEMBL30633343

SCHEMBL30633343

Nc1n[nH]c2ccc(-c3ccnc(NC(=O)NCc4cccnc4)c3)cc12

nearest known ligand 0.62

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
▸ MAPK1 P28482 13/20 0.54
▸ DYRK1A Q13627 2/20 0.49
▸ PIK3C3 Q8NEB9 2/20 0.49
▸ SMN1; SMN2 Q16637 1/20 0.47
▸ L3MBTL1 Q9Y468 1/20 0.47

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
SCHEMBL26685765 1.00 MAPK1 (0.54) MAPK1DYRK1APIK3C3SMN1; SMN2L3MBTL1
SCHEMBL26685951 0.90 MAPK1 (0.59) MAPK1
SCHEMBL30633307 0.90 MAPK1 (0.59) MAPK1
SCHEMBL30633274 0.88 JAK2 (0.54) MAPK1
SCHEMBL26686405 0.88 JAK2 (0.54) MAPK1
SCHEMBL31240563 0.87 DYRK1A (0.51) DYRK1APIK3C3
SCHEMBL30633283 0.84 DYRK1A (0.52) MAPK1DYRK1A
SCHEMBL26686348 0.84 DYRK1A (0.52) MAPK1DYRK1A
SCHEMBL30633337 0.83 MAPK1 (0.60) MAPK1SMN1; SMN2
SCHEMBL30633290 0.83 MAPK1 (0.51) MAPK1PIK3C3SMN1; SMN2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-119562945-A IKK inhibitors 癌症研究技术有限公司 2025-03-04 — — CN 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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