SCHEMBL20097299

SCHEMBL20097299

C=C(Nc1ccncc1)c1n[nH]c2ccc(-c3cccnc3)cc12

nearest known ligand 0.62

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
DYRK1A Q13627 20/20 0.62
CLK2 P49760 2/20 0.62
CLK3 P49761 2/20 0.62
WNT1 P04628 12/20 0.59

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
SCHEMBL20097420 0.87 DYRK1A (0.60) DYRK1ACLK2CLK3WNT1
SCHEMBL5716427 0.86 DYRK1A (0.82) DYRK1ACLK2CLK3WNT1
SCHEMBL20097399 0.86 DYRK1A (0.64) DYRK1ACLK2CLK3WNT1
Hydrochloric Acid SCHEMBL952393 0.85 DYRK1A (0.80) DYRK1ACLK2CLK3WNT1
SCHEMBL20097139 0.85 DYRK1A (0.55) DYRK1ACLK2CLK3WNT1
SCHEMBL20097379 0.83 DYRK1A (0.63) DYRK1ACLK2CLK3WNT1
SCHEMBL20097428 0.83 DYRK1A (0.57) DYRK1ACLK2CLK3WNT1
SCHEMBL20097241 0.82 DYRK1A (0.58) DYRK1ACLK2CLK3WNT1
SCHEMBL20097145 0.81 DYRK1A (0.66) DYRK1ACLK2CLK3WNT1
SCHEMBL20097419 0.81 DYRK1A (0.65) 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