SCHEMBL17364523

SCHEMBL17364523

Nc1ccc(NC(=O)c2n[nH]c3ccc(-c4cncc(CN5CCC(O)CC5)c4)cc23)cn1

nearest known ligand 0.78

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
▸ DYRK1A Q13627 17/20 0.78
▸ CLK2 P49760 14/20 0.78
▸ CLK3 P49761 14/20 0.78
▸ WNT1 P04628 12/20 0.71

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
SCHEMBL14792504 0.92 DYRK1A (0.78) DYRK1ACLK2CLK3WNT1
SCHEMBL14792146 0.92 DYRK1A (0.83) DYRK1ACLK2CLK3WNT1
SCHEMBL17364521 0.92 DYRK1A (0.82) DYRK1ACLK2CLK3WNT1
SCHEMBL17364525 0.92 DYRK1A (0.83) DYRK1ACLK2CLK3WNT1
SCHEMBL14792443 0.91 DYRK1A (0.93) DYRK1ACLK2CLK3WNT1
SCHEMBL14804268 0.91 DYRK1A (0.84) DYRK1ACLK2CLK3WNT1
SCHEMBL15473301 0.91 DYRK1A (0.85) DYRK1ACLK2CLK3WNT1
SCHEMBL14792433 0.90 DYRK1A (0.90) DYRK1ACLK2CLK3WNT1
SCHEMBL14792771 0.90 DYRK1A (0.82) DYRK1ACLK2CLK3WNT1
SCHEMBL14785601 0.90 DYRK1A (0.93) DYRK1ACLK2CLK3WNT1

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
US-9221793-B2 Indazole-3-carboxamides and their use as Wnt/β-catenin signaling pathway inhibitors SAMUMED, LLC (US) 2015-12-29 — — US disclosed
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