SCHEMBL30756821

SCHEMBL30756821

Cc1cnc(Nc2cc(C)n(C)n2)nc1-c1c[nH]c2c([N+](=O)[O-])cccc12

nearest known ligand 0.46

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
▸ CLK1 P49759 2/20 0.46
▸ JAK1 P23458 15/20 0.44
▸ JAK2 O60674 13/20 0.44
▸ DYRK1A Q13627 1/20 0.42
▸ GSK3B P49841 1/20 0.42
▸ CDK5 Q00535 1/20 0.42
▸ CDK5R1 Q15078 1/20 0.42
▸ KCNH2 Q12809 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
SCHEMBL26987746 1.00 CLK1 (0.46) CLK1JAK1JAK2DYRK1AGSK3B
SCHEMBL26987459 0.86 JAK1 (0.39) CLK1JAK1JAK2KCNH2
SCHEMBL30757260 0.86 JAK1 (0.39) CLK1JAK1JAK2KCNH2
SCHEMBL30757032 0.85 JAK1 (0.40) JAK1JAK2KCNH2
SCHEMBL26987611 0.85 JAK1 (0.40) JAK1JAK2KCNH2
SCHEMBL26993838 0.84 JAK1 (0.47) JAK1JAK2KCNH2
SCHEMBL30756723 0.84 JAK1 (0.46) CLK1JAK1JAK2CDK5CDK5R1
SCHEMBL26987136 0.84 JAK1 (0.46) CLK1JAK1JAK2CDK5CDK5R1
SCHEMBL29466936 0.83 JAK1 (0.62) JAK1JAK2
SCHEMBL30757036 0.83 JAK1 (0.37) JAK1JAK2KCNH2

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-4551570-A1 NOVEL COMPOUNDS AS GCN2 INHIBITORS, PHARMACEUTICAL COMPOSITIONS AND USES THEREOF Dong-A ST Co., Ltd. (KR) 2025-05-14 — — EP disclosed
CN-119403798-A Novel compounds as GCN2 inhibitors, pharmaceutical compositions and uses thereof 东亚ST 株式会社 2025-02-07 — — CN disclosed
WO-2024009215-A1 NOVEL COMPOUNDS AS GCN2 INHIBITORS, PHARMACEUTICAL COMPOSITIONS AND USES THEREOF DONG-A ST CO., LTD. (KR) 2024-01-11 — — WO disclosed
Send feedback