SCHEMBL17121391

SCHEMBL17121391

CNCCNC(=O)c1n[nH]c2ccc(-c3cccnc3)cc12

nearest known ligand 0.78

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
DYRK1A Q13627 19/20 0.78
WNT1 P04628 13/20 0.78
CLK2 P49760 2/20 0.72
CLK3 P49761 2/20 0.72
GSK3B P49841 1/20 0.64
KCNH2 Q12809 1/20 0.64

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
SCHEMBL17095563 0.88 DYRK1A (1.00) DYRK1AWNT1CLK2CLK3GSK3B
SCHEMBL17095854 0.85 DYRK1A (1.00) DYRK1AWNT1CLK2CLK3GSK3B
SCHEMBL17095971 0.84 DYRK1A (1.00) DYRK1AWNT1CLK2CLK3GSK3B
SCHEMBL6219544 0.84 DYRK1A (0.72) DYRK1AWNT1CLK2CLK3GSK3B
SCHEMBL17095496 0.84 DYRK1A (1.00) DYRK1AWNT1CLK2CLK3GSK3B
SCHEMBL20125806 0.83 DYRK1A (0.71) DYRK1AWNT1CLK2CLK3GSK3B
SCHEMBL17096031 0.83 DYRK1A (1.00) DYRK1AWNT1CLK2CLK3GSK3B
SCHEMBL17095758 0.81 DYRK1A (1.00) DYRK1AWNT1CLK2CLK3GSK3B
SCHEMBL17096785 0.81 DYRK1A (0.78) DYRK1AWNT1CLK2CLK3GSK3B
SCHEMBL17095451 0.81 DYRK1A (1.00) 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 1 patent. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2015143380-A1 5-SUBSTITUTED INDAZOLE-3-CARBOXAMIDES AND PREPARATION AND USE THEREOF SAMUMED, LLC (US) 2015-09-24 WO disclosed