SCHEMBL20097429

SCHEMBL20097429

C=C(Nc1ccc(CN2CCCC2)nc1)c1n[nH]c2ccc(-c3cccnc3)cc12

nearest known ligand 0.71

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
DYRK1A Q13627 17/20 0.71
CLK2 P49760 8/20 0.71
CLK3 P49761 8/20 0.71
WNT1 P04628 15/20 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
SCHEMBL14792481 0.90 DYRK1A (0.88) DYRK1ACLK2CLK3WNT1
SCHEMBL14792143 0.89 DYRK1A (0.86) DYRK1ACLK2CLK3WNT1
SCHEMBL14791953 0.88 DYRK1A (0.88) DYRK1ACLK2CLK3WNT1
SCHEMBL23889830 0.86 WNT1 (0.58) DYRK1ACLK2CLK3WNT1
SCHEMBL20097419 0.85 DYRK1A (0.65) DYRK1ACLK2CLK3WNT1
SCHEMBL20097345 0.84 DYRK1A (0.68) DYRK1ACLK2CLK3WNT1
SCHEMBL20097436 0.84 DYRK1A (0.80) DYRK1ACLK2CLK3WNT1
SCHEMBL23889825 0.84 DYRK1A (0.54) DYRK1ACLK2CLK3WNT1
SCHEMBL14785595 0.83 DYRK1A (1.00) DYRK1ACLK2CLK3WNT1
SCHEMBL20097154 0.83 DYRK1A (0.81) 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
WO-2018075858-A1 METHODS OF USING INDAZOLE-3-CARBOXAMIDES AND THEIR USE AS WNT/B-CATENIN SIGNALING PATHWAY INHIBITORS SAMUMED, LLC (US) 2018-04-26 WO disclosed