SCHEMBL30633364

SCHEMBL30633364

Nc1n[nH]c2c(Cl)cc(-c3ccnc4[nH]c(C(=O)NCCN5CCCCC5)cc34)cc12

nearest known ligand 0.44

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
▸ AURKA O14965 3/20 0.44
▸ AURKB Q96GD4 3/20 0.44
▸ NUDT1 P36639 4/20 0.44
▸ WNT1 P04628 4/20 0.44
▸ DYRK1A Q13627 4/20 0.44
▸ KDM4E B2RXH2 2/20 0.43
▸ HSD17B10 Q99714 1/20 0.43
▸ RHEB Q15382 1/20 0.43
▸ PARP1 P09874 1/20 0.41
▸ SYK P43405 1/20 0.40
▸ APP P05067 1/20 0.40

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
SCHEMBL26686398 1.00 AURKA (0.44) AURKAAURKBNUDT1WNT1DYRK1A
SCHEMBL26686261 0.85 DYRK1A (0.56) AURKAAURKBNUDT1WNT1DYRK1A
SCHEMBL30633374 0.85 DYRK1A (0.56) AURKAAURKBNUDT1WNT1DYRK1A
SCHEMBL26686587 0.81 KDM4E (0.55) WNT1DYRK1AKDM4EHSD17B10RHEB
SCHEMBL30633400 0.81 KDM4E (0.55) WNT1DYRK1AKDM4EHSD17B10RHEB
SCHEMBL26686734 0.74 CCNK (0.44) AURKAAURKB
SCHEMBL31240454 0.74 DYRK1A (0.54) WNT1DYRK1APARP1APP
SCHEMBL31240468 0.72 CCNK (0.52) NUDT1
SCHEMBL26686752 0.72 CCNK (0.52) NUDT1
SCHEMBL31240736 0.72 NUDT1 (0.49) NUDT1WNT1DYRK1A

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 7 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
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
Send feedback