SCHEMBL30399503

SCHEMBL30399503

O=C(Nc1cnn(C2CCNCC2)c1)c1cnc2[nH]cc(-c3ccc4c(c3)C3(CCNCC3)CC4=O)c2c1

nearest known ligand 0.43

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
▸ PAK1 Q13153 14/20 0.43
▸ DYRK1A Q13627 5/20 0.43
▸ CLK1 P49759 2/20 0.43
▸ DYRK1B Q9Y463 2/20 0.43
▸ MAPK7 Q13164 1/20 0.42
▸ GSK3B P49841 3/20 0.42
▸ PAK4 O96013 2/20 0.41
▸ DYRK2 Q92630 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
SCHEMBL26175103 1.00 PAK1 (0.43) PAK1DYRK1ACLK1DYRK1BMAPK7
SCHEMBL30399134 0.94 DYRK1A (0.42) PAK1DYRK1ACLK1DYRK1BMAPK7
SCHEMBL26175144 0.94 DYRK1A (0.42) PAK1DYRK1ACLK1DYRK1BMAPK7
SCHEMBL26175104 0.94 DYRK1A (0.42) PAK1DYRK1ACLK1DYRK1BMAPK7
SCHEMBL30399237 0.94 DYRK1A (0.42) PAK1DYRK1ACLK1DYRK1BMAPK7
SCHEMBL30400199 0.89 DYRK1A (0.44) PAK1DYRK1ACLK1DYRK1BMAPK7
SCHEMBL26175145 0.89 DYRK1A (0.44) PAK1DYRK1ACLK1DYRK1BMAPK7
SCHEMBL30399311 0.86 DYRK1A (0.42) PAK1DYRK1ACLK1DYRK1BMAPK7
SCHEMBL26175107 0.86 DYRK1A (0.42) PAK1DYRK1ACLK1DYRK1BMAPK7
SCHEMBL30400229 0.85 DYRK1A (0.44) PAK1DYRK1ACLK1DYRK1BMAPK7

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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