SCHEMBL30621971

SCHEMBL30621971

CN1CCN(c2ccc(Nc3nccc(N4CCC(C)(NS(=O)(=O)C5CC5)CC4)n3)cc2)CC1

nearest known ligand 0.53

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
▸ JAK2 O60674 7/20 0.53
▸ FLT3 P36888 1/20 0.53
▸ BRD4 O60885 9/20 0.51
▸ MKNK1 Q9BUB5 1/20 0.50
▸ EGFR P00533 2/20 0.48
▸ FGFR4 P22455 1/20 0.47
▸ JAK3 P52333 2/20 0.47
▸ JAK1 P23458 1/20 0.47
▸ BRD2 P25440 1/20 0.47
▸ BRD3 Q15059 1/20 0.47
▸ BRDT Q58F21 1/20 0.47
▸ CDK4 P11802 1/20 0.46
▸ CCND1 P24385 1/20 0.46
▸ CCND2 P30279 1/20 0.46
▸ CCND3 P30281 1/20 0.46
▸ HRH4 Q9H3N8 2/20 0.45
▸ AURKA O14965 1/20 0.45
▸ FLT4 P35916 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
SCHEMBL29097558 1.00 JAK2 (0.53) JAK2FLT3BRD4MKNK1EGFR
SCHEMBL23276938 0.84 JAK2 (0.60) JAK2JAK3JAK1
SCHEMBL29097718 0.83 BRD4 (0.59) JAK2BRD4EGFRFGFR4JAK3
SCHEMBL30621969 0.79 JAK2 (0.54) JAK2FLT3MKNK1EGFRJAK3
SCHEMBL29097561 0.79 JAK2 (0.54) JAK2FLT3MKNK1EGFRJAK3
SCHEMBL29097550 0.78 BRD4 (0.56) JAK2BRD4EGFRFGFR4JAK3
SCHEMBL30621975 0.77 TRPV1 (0.41) —
SCHEMBL29097705 0.77 TRPV1 (0.41) —
SCHEMBL28322770 0.74 JAK2 (0.71) JAK2FLT3MKNK1EGFRJAK3
SCHEMBL4784156 0.72 AURKA (0.59) JAK2FLT3BRD4MKNK1EGFR

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 3 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-4745132-A1 PYRIMIDINAMINE NUAK INHIBITOR, AND PREPARATION METHOD THEREFOR AND USE THEREOF Technoderma Medicines Inc. (CN) 2026-05-20 — — EP disclosed
WO-2025011447-A1 PYRIMIDINAMINE NUAK INHIBITOR, AND PREPARATION METHOD THEREFOR AND USE THEREOF 特科罗生物科技(成都)有限公司 2025-01-16 — — WO disclosed
CN-116903592-A Pyrimidine amine NUAK inhibitor and preparation method and application thereof 特科罗生物科技(成都)有限公司 2023-10-20 — — CN disclosed
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