SCHEMBL24727537

SCHEMBL24727537

CN(C)S(=O)(=O)c1ccccc1Nc1nc(Nc2ccc(CN3CCN(N)CC3)cc2)ncc1Cl

nearest known ligand 0.86

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
▸ AXL P30530 14/20 0.86
▸ AURKA O14965 1/20 0.86
▸ AURKB Q96GD4 1/20 0.86
▸ NEK2 P51955 1/20 0.68
▸ PTK2 Q05397 5/20 0.64
▸ ALK Q9UM73 1/20 0.54

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
SCHEMBL21446913 0.92 AXL (0.87) AXLAURKAAURKBNEK2PTK2
Dubermatinib SCHEMBL29394359 0.92 AXL (1.00) AXLAURKAAURKBNEK2PTK2
Dubermatinib SCHEMBL12813478 0.92 AXL (1.00) AXLAURKAAURKBNEK2PTK2
SCHEMBL21446896 0.90 AXL (0.83) AXLAURKAAURKBNEK2PTK2
SCHEMBL22872062 0.88 AXL (0.79) AXLAURKAAURKBNEK2PTK2
SCHEMBL22872061 0.88 AXL (0.79) AXLAURKAAURKBNEK2PTK2
Dubermatinib SCHEMBL29814405 0.86 AXL (0.87) AXLAURKAAURKBNEK2PTK2
Dubermatinib SCHEMBL29814119 0.86 AXL (0.87) AXLAURKAAURKBNEK2PTK2
SCHEMBL21446914 0.86 AXL (0.76) AXLAURKAAURKBNEK2PTK2
Dubermatinib SCHEMBL30437663 0.86 AXL (0.87) AXLAURKAAURKBNEK2PTK2

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-2022261504-A1 DENDRIMER CONJUGATES AND METHODS OF USE THEREOF Ashvattha Therapeutics, Inc. (US) 2022-12-15 — — WO disclosed
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