SCHEMBL20097282

SCHEMBL20097282

C=C(NC1CCCC1)c1ccc(NC(=C)c2n[nH]c3ccc(-c4cccnc4)cc23)cn1

nearest known ligand 0.63

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
DYRK1A Q13627 20/20 0.63
WNT1 P04628 15/20 0.62
CLK2 P49760 1/20 0.49
CLK3 P49761 1/20 0.49

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
SCHEMBL14785590 0.85 DYRK1A (0.77) DYRK1AWNT1CLK2CLK3
SCHEMBL23889825 0.84 DYRK1A (0.54) DYRK1AWNT1CLK2CLK3
SCHEMBL20097407 0.83 DYRK1A (0.60) DYRK1AWNT1CLK2CLK3
SCHEMBL20097410 0.82 DYRK1A (0.67) DYRK1AWNT1CLK2CLK3
SCHEMBL20097399 0.82 DYRK1A (0.64) DYRK1AWNT1CLK2CLK3
SCHEMBL20097379 0.81 DYRK1A (0.63) DYRK1AWNT1CLK2CLK3
SCHEMBL20097419 0.80 DYRK1A (0.65) DYRK1AWNT1CLK2CLK3
SCHEMBL20097299 0.79 DYRK1A (0.62) DYRK1AWNT1CLK2CLK3
SCHEMBL20097429 0.78 DYRK1A (0.71) DYRK1AWNT1CLK2CLK3
SCHEMBL17095539 0.78 DYRK1A (1.00) DYRK1AWNT1

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