SCHEMBL21312366

SCHEMBL21312366

Cc1cc(-c2cnc(C)n2C)cc2c(C(=O)N[C@@H](C)C(F)(F)F)n[nH]c12

nearest known ligand 0.75

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
DYRK1A Q13627 19/20 0.75
GSK3B P49841 15/20 0.75
CLK2 P49760 2/20 0.45
CLK3 P49761 2/20 0.45
PRMT5 O14744 1/20 0.36
WDR77 Q9BQA1 1/20 0.36
WNT1 P04628 1/20 0.34

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
SCHEMBL21292328 0.92 DYRK1A (0.72) DYRK1AGSK3BCLK2CLK3
SCHEMBL21292327 0.92 DYRK1A (0.72) DYRK1AGSK3BCLK2CLK3
SCHEMBL21292359 0.85 DYRK1A (1.00) DYRK1AGSK3BCLK2CLK3WNT1
SCHEMBL21292358 0.85 DYRK1A (1.00) DYRK1AGSK3BCLK2CLK3WNT1
SCHEMBL21312368 0.81 GSK3B (0.72) DYRK1AGSK3B
SCHEMBL21292369 0.76 DYRK1A (1.00) DYRK1AGSK3BCLK2CLK3
SCHEMBL21292368 0.76 DYRK1A (1.00) DYRK1AGSK3BCLK2CLK3
SCHEMBL21312150 0.74 DYRK1A (0.79) DYRK1AGSK3BCLK2CLK3PRMT5
SCHEMBL21292345 0.74 DYRK1A (1.00) DYRK1AGSK3BCLK2CLK3WNT1
SCHEMBL21292366 0.72 GSK3B (0.71) DYRK1AGSK3B

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-2019165192-A1 5-HETEROARYL SUBSTITUTED INDAZOLE-3-CARBOXAMIDES AND PREPARATION AND USE THEREOF SAMUMED, LLC (US) 2019-08-29 WO disclosed