SCHEMBL30399574

SCHEMBL30399574

CN1CCC(Nc2ncnc3ccc(-c4c[nH]c5ncc(C(=O)Nc6cnn(C7CCN(C)CC7)c6)cc45)cc23)CC1

nearest known ligand 0.46

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
▸ MELK Q14680 3/20 0.46
▸ DYRK1A Q13627 8/20 0.46
▸ GSK3B P49841 3/20 0.46
▸ CLK2 P49760 3/20 0.46
▸ CLK3 P49761 3/20 0.46
▸ DYRK1B Q9Y463 4/20 0.43
▸ MAPK7 Q13164 1/20 0.43
▸ IRAK4 Q9NWZ3 6/20 0.43
▸ CLK1 P49759 1/20 0.42
▸ CD38 P28907 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
SCHEMBL26175154 1.00 MELK (0.46) MELKDYRK1AGSK3BCLK2CLK3
SCHEMBL30400581 0.96 CYP1A2 (0.44) MELKDYRK1AGSK3BCLK2CLK3
SCHEMBL26175114 0.96 CYP1A2 (0.44) MELKDYRK1AGSK3BCLK2CLK3
SCHEMBL30399094 0.89 DYRK1A (0.48) MELKDYRK1AGSK3BCLK2CLK3
SCHEMBL26175152 0.89 DYRK1A (0.48) MELKDYRK1AGSK3BCLK2CLK3
SCHEMBL26175151 0.88 MELK (0.46) MELKDYRK1AGSK3BCLK2CLK3
SCHEMBL30399215 0.88 MELK (0.46) MELKDYRK1AGSK3BCLK2CLK3
SCHEMBL30400110 0.87 MELK (0.48) MELKDYRK1AGSK3BCLK2CLK3
SCHEMBL26175153 0.87 MELK (0.48) MELKDYRK1AGSK3BCLK2CLK3
SCHEMBL30399724 0.86 DYRK1A (0.51) DYRK1ADYRK1BIRAK4CD38

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
EP-4415817-A1 1H-PYRROLO[2,3-B]PYRIDINES AS DYRK1A INHIBITORS BioSplice Therapeutics, Inc. (US) 2024-08-21 — — EP claimed
WO-2023064349-A1 1H-PYRROLO[2,3-B]PYRIDINES AS DYRK1A INHIBITORS BIOSPLICE THERAPEUTICS, INC. (US) 2023-04-20 — — WO claimed
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