SCHEMBL26685751

SCHEMBL26685751

Nc1n[nH]c2ccc(-c3ccnc4[nH]c(C(=O)N5CCCC5)cc34)cc12

nearest known ligand 0.53

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
▸ TBK1 Q9UHD2 3/20 0.53
▸ JAK2 O60674 3/20 0.48
▸ BTK Q06187 1/20 0.43
▸ NUDT1 P36639 4/20 0.43
▸ DYRK1A Q13627 4/20 0.42
▸ CLK2 P49760 3/20 0.42
▸ CLK3 P49761 2/20 0.42
▸ WNT1 P04628 1/20 0.40
▸ ABL1 P00519 3/20 0.39
▸ BCR P11274 3/20 0.39
▸ HRH4 Q9H3N8 1/20 0.39
▸ HRH3 Q9Y5N1 1/20 0.39
▸ KDM5A P29375 1/20 0.39
▸ KDM4C Q9H3R0 1/20 0.39
▸ KDM5B Q9UGL1 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
SCHEMBL31420127 1.00 TBK1 (0.53) TBK1JAK2BTKNUDT1DYRK1A
SCHEMBL30633298 0.91 TBK1 (0.55) TBK1JAK2DYRK1ACLK2CLK3
SCHEMBL26685843 0.91 TBK1 (0.55) TBK1JAK2DYRK1ACLK2CLK3
SCHEMBL26686408 0.84 NUDT1 (0.48) JAK2NUDT1DYRK1ACLK2CLK3
SCHEMBL26685791 0.84 NUDT1 (0.60) JAK2NUDT1DYRK1ACLK2CLK3
SCHEMBL31240425 0.84 NUDT1 (0.48) JAK2NUDT1DYRK1ACLK2CLK3
SCHEMBL31420159 0.84 NUDT1 (0.60) JAK2NUDT1DYRK1ACLK2CLK3
SCHEMBL30633374 0.82 DYRK1A (0.56) NUDT1DYRK1ACLK2CLK3WNT1
SCHEMBL26686261 0.82 DYRK1A (0.56) NUDT1DYRK1ACLK2CLK3WNT1
SCHEMBL30633398 0.81 NUDT1 (0.46) JAK2NUDT1DYRK1ACLK2CLK3

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 11 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
US-20250304576-A1 IKK INHIBITORS CANCER RESEARCH TECH LTD (GB) 2025-10-02 — — US claimed
EP-4522597-A1 IKK INHIBITORS Cancer Research Technology Limited (GB) 2025-03-19 — — EP claimed
WO-2024228035-A1 IKK-ALPHA INHIBITORS CANCER RESEARCH TECHNOLOGY LIMITED (GB) 2024-11-07 — — WO claimed
WO-2023218201-A1 IKK INHIBITORS CANCER RESEARCH TECHNOLOGY LIMITED (GB) 2023-11-16 — — WO claimed
EP-4705291-A1 IKK-ALPHA INHIBITORS Cancer Research Technology Limited (GB) 2026-03-11 — — EP disclosed
US-20250304576-A1 IKK INHIBITORS CANCER RESEARCH TECH LTD (GB) 2025-10-02 — — US disclosed
EP-4522597-A1 IKK INHIBITORS Cancer Research Technology Limited (GB) 2025-03-19 — — EP 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
WO-2023218201-A1 IKK INHIBITORS CANCER RESEARCH TECHNOLOGY LIMITED (GB) 2023-11-16 — — WO disclosed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (1 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.

PatentTitleText reads most aboutPredicted target · text-rank
US-20250304576-A1 IKK INHIBITORS NFKBIA, IKBKE, IKBKB TBK1 11/4885JAK2 207/4885BTK 169/4885

“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.

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