SCHEMBL31240484

SCHEMBL31240484

Nc1n[nH]c2ccc(-c3ccnc(NC(=O)c4ccccc4)c3)cc12

nearest known ligand 0.63

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
▸ JAK2 O60674 8/20 0.63
▸ JAK1 P23458 5/20 0.63
▸ CDK7 P50613 7/20 0.54
▸ ULK1 O75385 1/20 0.51
▸ DYRK1A Q13627 1/20 0.49
▸ MAPK10 P53779 2/20 0.49
▸ MAPK8 P45983 1/20 0.49
▸ MAPK9 P45984 1/20 0.48
▸ KIT P10721 1/20 0.48
▸ FLT3 P36888 1/20 0.48

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
SCHEMBL26686431 1.00 JAK2 (0.63) JAK2JAK1CDK7ULK1DYRK1A
SCHEMBL31240407 0.90 JAK2 (0.63) JAK2JAK1CDK7ULK1DYRK1A
SCHEMBL26686340 0.87 JAK2 (0.56) JAK2JAK1ULK1DYRK1A
SCHEMBL26686370 0.86 JAK2 (0.61) JAK2JAK1ULK1DYRK1AKIT
SCHEMBL31420124 0.86 JAK2 (0.61) JAK2JAK1ULK1DYRK1AKIT
SCHEMBL26685861 0.85 JAK2 (0.56) JAK2JAK1DYRK1AKITFLT3
SCHEMBL30633352 0.85 JAK2 (0.56) JAK2JAK1DYRK1AKITFLT3
SCHEMBL31240493 0.84 WNT3A (0.57) JAK2DYRK1A
SCHEMBL31240431 0.83 NPC1 (0.48) JAK2JAK1ULK1DYRK1AMAPK10
SCHEMBL30633307 0.82 MAPK1 (0.59) JAK2

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 5 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
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
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