SCHEMBL30633290

SCHEMBL30633290

Nc1n[nH]c2ccc(-c3ccnc(NC(=O)NCCc4ccccc4)c3)cc12

nearest known ligand 0.59

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
▸ MAPK1 P28482 11/20 0.51
▸ MAPK3 P27361 1/20 0.50
▸ ROCK2 O75116 2/20 0.47
▸ ROCK1 Q13464 2/20 0.47
▸ JAK2 O60674 2/20 0.47
▸ F11 P03951 1/20 0.47
▸ PIK3C3 Q8NEB9 1/20 0.47
▸ KIT P10721 1/20 0.46
▸ PDGFRA P16234 1/20 0.46
▸ KDR P35968 1/20 0.46
▸ NPC1 O15118 1/20 0.45
▸ ALDH1A1 P00352 1/20 0.45
▸ RAB9A P51151 1/20 0.45
▸ SMN1; SMN2 Q16637 1/20 0.45

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
SCHEMBL26686121 1.00 MAPK1 (0.51) MAPK1MAPK3ROCK2ROCK1JAK2
SCHEMBL26685951 0.90 MAPK1 (0.59) MAPK1MAPK3JAK2F11
SCHEMBL30633307 0.90 MAPK1 (0.59) MAPK1MAPK3JAK2F11
SCHEMBL26686173 0.87 MAPK1 (0.56) MAPK1ROCK2ROCK1JAK2
SCHEMBL30633349 0.87 MAPK1 (0.56) MAPK1ROCK2ROCK1JAK2
SCHEMBL31240507 0.86 TTK (0.50) JAK2F11PIK3C3NPC1ALDH1A1
SCHEMBL31240475 0.86 MAPK1 (0.57) MAPK1ROCK2ROCK1JAK2KDR
SCHEMBL26685737 0.86 MAPK1 (0.57) MAPK1ROCK2ROCK1JAK2KDR
SCHEMBL30633294 0.85 MAPK1 (0.49) MAPK1ROCK2ROCK1JAK2
SCHEMBL26685933 0.85 MAPK1 (0.49) MAPK1ROCK2ROCK1JAK2

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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