SCHEMBL2489896

SCHEMBL2489896

CC(C)(C)OC(=O)ON1CCC(COc2cnc(-c3cccc(Cn4nc(-c5cccc(C(N)=O)c5)ccc4=O)c3)nc2)CC1

nearest known ligand 0.61

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
▸ MET P08581 18/20 0.61
▸ NQO2 P16083 1/20 0.61
▸ CHEK2 O96017 1/20 0.38
▸ IRAK1 P51617 1/20 0.37

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
SCHEMBL1296715 0.90 MET (0.76) METNQO2
SCHEMBL2531744 0.90 MET (0.62) METNQO2CHEK2
SCHEMBL2455889 0.88 MET (0.78) METNQO2
SCHEMBL2535395 0.85 MET (0.65) METNQO2
SCHEMBL12216835 0.83 MET (0.72) METNQO2
SCHEMBL2455548 0.81 MET (0.79) METNQO2
SCHEMBL3084089 0.81 MET (0.78) METNQO2
SCHEMBL2455804 0.80 MET (0.72) METNQO2
SCHEMBL2480686 0.80 MET (0.80) METNQO2
SCHEMBL12106973 0.80 MET (0.60) METNQO2

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 2 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2367815-A1 PYRIDAZINONE DERIVATIVES Merck Patent GmbH (DE) 2011-09-28 — — EP disclosed
WO-2010072296-A1 PYRIDAZINONE DERIVATIVES MERCK PATENT GMBH (DE) 2010-07-01 — — WO disclosed
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