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Sugi Predict / Compounds / SCHEMBL22697276

SCHEMBL22697276

SCHEMBL22697276

O=C(c1ccc(-c2ccc3ncc(-c4cc5ccccc5o4)n3n2)cc1)N1CCCCC1

nearest known ligand 1.00 ✓ in ChEMBL — recovers established targets

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
▸ MKNK1 Q9BUB5 20/20 1.00
▸ MKNK2 Q9HBH9 20/20 1.00
▸ EIF4E P06730 13/20 0.85
▸ KCNH2 Q12809 3/20 0.81

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
SCHEMBL22697335 0.99 MKNK1 (0.98) MKNK1MKNK2EIF4EKCNH2
SCHEMBL22697152 0.92 MKNK1 (1.00) MKNK1MKNK2EIF4EKCNH2
SCHEMBL22697346 0.92 MKNK1 (1.00) MKNK1MKNK2EIF4EKCNH2
SCHEMBL22697310 0.91 MKNK1 (1.00) MKNK1MKNK2EIF4EKCNH2
SCHEMBL22697153 0.91 MKNK1 (1.00) MKNK1MKNK2EIF4EKCNH2
SCHEMBL22697331 0.91 MKNK1 (1.00) MKNK1MKNK2EIF4EKCNH2
SCHEMBL22697341 0.89 MKNK1 (0.84) MKNK1MKNK2EIF4EKCNH2
SCHEMBL22697309 0.89 MKNK1 (1.00) MKNK1MKNK2EIF4EKCNH2
SCHEMBL22697333 0.89 MKNK1 (0.82) MKNK1MKNK2EIF4EKCNH2
SCHEMBL22697090 0.88 MKNK1 (1.00) MKNK1MKNK2EIF4EKCNH2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-111978325-B Imidazopyridazine MNK1/MNK2 kinase inhibitor, and preparation method and application thereof 中国药科大学 2023-11-17 — — CN disclosed
WO-2020233716-A1 IMIDAZOPYRIDAZINE MNK1/MNK2 KINASE INHIBITORS, PREPARATION METHOD THEREFOR AND USE THEREOF 上海道熵生物科技有限公司 (CN) 2020-11-26 — — WO disclosed