SCHEMBL11890486

SCHEMBL11890486

C=C(Nc1cc(C(=O)NC(CCNC(=O)OC(C)(C)C)c2ccccc2)ccc1Cl)c1cc2ccc(OC)nc2[nH]c1=O

nearest known ligand 0.54

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
▸ DYRK1A Q13627 20/20 0.54
▸ DYRK1B Q9Y463 16/20 0.54

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
SCHEMBL10322018 0.94 DYRK1A (0.61) DYRK1ADYRK1B
SCHEMBL11951534 0.88 DYRK1A (0.67) DYRK1ADYRK1B
SCHEMBL10322496 0.87 DYRK1A (0.55) DYRK1ADYRK1B
SCHEMBL10323165 0.85 DYRK1A (0.65) DYRK1ADYRK1B
SCHEMBL10323802 0.83 DYRK1A (0.78) DYRK1ADYRK1B
SCHEMBL11949604 0.83 DYRK1A (0.78) DYRK1ADYRK1B
SCHEMBL10323803 0.83 DYRK1A (0.78) DYRK1ADYRK1B
SCHEMBL10321795 0.83 DYRK1A (0.66) DYRK1ADYRK1B
SCHEMBL11952007 0.82 DYRK1A (0.72) DYRK1ADYRK1B
SCHEMBL10322778 0.82 DYRK1A (0.76) DYRK1ADYRK1B

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-2012098066-A1 1,6- AND 1,8-NAPHTHYRIDINES USEFUL AS DYRK1 INHIBITORS F. HOFFMANN-LA ROCHE AG (CH) 2012-07-26 — — WO disclosed
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