SCHEMBL30833188

SCHEMBL30833188

COc1ccc2sc(-c3cnccc3NC(=O)OC(C)(C)C)nc2c1

nearest known ligand 0.76

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
DYRK1A Q13627 20/20 0.76
CLK1 P49759 1/20 0.50
CLK2 P49760 1/20 0.50
DYRK2 Q92630 1/20 0.50
CLK4 Q9HAZ1 1/20 0.50
DYRK1B Q9Y463 1/20 0.50

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
SCHEMBL23015688 1.00 DYRK1A (0.76) DYRK1ACLK1CLK2DYRK2CLK4
SCHEMBL23015687 0.90 DYRK1A (0.79) DYRK1A
SCHEMBL30833187 0.90 DYRK1A (0.79) DYRK1A
SCHEMBL23015693 0.87 DYRK1A (1.00) DYRK1ACLK1CLK2DYRK2CLK4
SCHEMBL30417087 0.87 DYRK1A (1.00) DYRK1ACLK1CLK2DYRK2CLK4
SCHEMBL17553301 0.85 DYRK1A (0.55) DYRK1A
SCHEMBL20068748 0.83 DYRK1A (1.00) DYRK1ACLK1CLK2DYRK2CLK4
Hydrochloric Acid SCHEMBL29159571 0.82 DYRK1A (0.98) DYRK1ACLK1CLK2DYRK2CLK4
Hydrochloric Acid SCHEMBL30417034 0.82 DYRK1A (0.98) DYRK1ACLK1CLK2DYRK2CLK4
SCHEMBL20068747 0.81 DYRK1A (1.00) DYRK1ACLK1CLK2DYRK2CLK4

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
EP-3526216-B1 BENZOTHIAZOLE DERIVATIVES AS DYRK1 INHIBITORS PHARMASUM THERAPEUTICS AS (NO) 2024-04-03 EP disclosed