SCHEMBL30633334

SCHEMBL30633334

Nc1n[nH]c2ccc(-c3ccnc(N[C@H]4CC[C@H](O)CC4)c3)cc12

nearest known ligand 0.53

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
▸ MAPK14 Q16539 6/20 0.53
▸ JAK2 O60674 6/20 0.50
▸ PDPK1 O15530 2/20 0.45
▸ AURKA O14965 1/20 0.45
▸ TGFBR1 P36897 1/20 0.45
▸ ROCK1 Q13464 1/20 0.45
▸ AURKB Q96GD4 1/20 0.45
▸ MAPK8 P45983 1/20 0.44
▸ MAPK9 P45984 1/20 0.44
▸ MAPK10 P53779 1/20 0.44
▸ DYRK1A Q13627 3/20 0.42
▸ CLK2 P49760 1/20 0.42
▸ CLK3 P49761 1/20 0.42
▸ WNT1 P04628 2/20 0.41
▸ F11 P03951 1/20 0.41
▸ CDC7 O00311 1/20 0.41

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
SCHEMBL26686081 1.00 MAPK14 (0.53) MAPK14JAK2PDPK1AURKATGFBR1
SCHEMBL31240888 0.89 JAK2 (0.50) MAPK14JAK2PDPK1AURKATGFBR1
SCHEMBL26685977 0.89 JAK2 (0.50) MAPK14JAK2PDPK1AURKATGFBR1
SCHEMBL26686403 0.88 JAK2 (0.52) MAPK14JAK2PDPK1AURKATGFBR1
SCHEMBL26685865 0.79 ULK1 (0.61) JAK2F11
SCHEMBL31240358 0.79 ULK1 (0.61) JAK2F11
SCHEMBL26685722 0.77 JAK2 (0.52) MAPK14JAK2PDPK1ROCK1AURKB
SCHEMBL31420125 0.76 DYRK1A (0.51) JAK2DYRK1AWNT1
SCHEMBL26685950 0.76 DYRK1A (0.51) JAK2DYRK1AWNT1
SCHEMBL26686344 0.76 MAPK14 (0.40) MAPK14PDPK1AURKATGFBR1ROCK1

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

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 MAPK14 653/4885JAK2 207/4885PDPK1 522/4885

“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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