SCHEMBL6220865

SCHEMBL6220865

O=C(Nc1ccc(N2CCOCC2)cc1)c1n[nH]c2ccc(-c3cccnc3)cc12

nearest known ligand 0.68

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
DYRK1A Q13627 19/20 0.68
WNT1 P04628 12/20 0.68
CLK2 P49760 3/20 0.68
CLK3 P49761 3/20 0.68
GSK3B P49841 1/20 0.61
KCNH2 Q12809 1/20 0.61

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
SCHEMBL14803957 0.90 DYRK1A (0.82) DYRK1AWNT1CLK2CLK3GSK3B
SCHEMBL5916105 0.90 DYRK1A (0.59) DYRK1AWNT1CLK2CLK3GSK3B
SCHEMBL14792247 0.90 DYRK1A (0.69) DYRK1AWNT1CLK2CLK3GSK3B
SCHEMBL14792600 0.89 DYRK1A (0.77) DYRK1AWNT1CLK2CLK3
SCHEMBL14792786 0.85 DYRK1A (0.66) DYRK1AWNT1CLK2CLK3
SCHEMBL14792098 0.85 DYRK1A (0.65) DYRK1AWNT1CLK2CLK3GSK3B
SCHEMBL14804413 0.85 DYRK1A (0.61) DYRK1AWNT1CLK2CLK3
SCHEMBL14792621 0.84 DYRK1A (0.84) DYRK1AWNT1CLK2CLK3GSK3B
SCHEMBL14792838 0.84 DYRK1A (0.75) DYRK1AWNT1CLK2CLK3GSK3B
SCHEMBL14804410 0.83 DYRK1A (0.76) DYRK1AWNT1CLK2CLK3

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1549620-A1 INDAZOLECARBOXAMIDE DERIVATIVES, PREPARATION AND USE THEREOF AS CDK1, CDK2 AND CDK4 INHIBITORS Sanofi-Aventis (FR) 2005-07-06 EP claimed
WO-2004031158-A1 INDAZOLECARBOXAMIDE DERIVATIVES, PREPARATION AND USE THEREOF AS CDK1, CDK2 AND CDK4 INHIBITORS SANOFI-AVENTIS (FR) 2004-04-15 WO claimed
EP-1549620-A1 INDAZOLECARBOXAMIDE DERIVATIVES, PREPARATION AND USE THEREOF AS CDK1, CDK2 AND CDK4 INHIBITORS Sanofi-Aventis (FR) 2005-07-06 EP disclosed
WO-2004031158-A1 INDAZOLECARBOXAMIDE DERIVATIVES, PREPARATION AND USE THEREOF AS CDK1, CDK2 AND CDK4 INHIBITORS SANOFI-AVENTIS (FR) 2004-04-15 WO disclosed