SCHEMBL13284451

SCHEMBL13284451

Nc1cccc(-c2ccc(=O)n(Cc3cccc(-c4ncc(O)cn4)c3)n2)c1

nearest known ligand 0.59

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
▸ MET P08581 19/20 0.59
▸ NQO2 P16083 1/20 0.49
▸ HDAC1 Q13547 1/20 0.46

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
SCHEMBL13285273 0.89 MET (0.59) METNQO2
SCHEMBL2532298 0.88 MET (0.58) METNQO2
SCHEMBL3095671 0.85 MET (0.81) MET
SCHEMBL12240062 0.85 MET (0.64) METNQO2
SCHEMBL13970438 0.85 MET (0.55) METNQO2
SCHEMBL12106975 0.85 MET (0.56) METNQO2
SCHEMBL29549899 0.85 MET (0.69) METNQO2
SCHEMBL1296338 0.85 MET (0.69) METNQO2
SCHEMBL14494768 0.84 MET (0.50) METHDAC1
SCHEMBL12240064 0.84 MET (0.58) 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
WO-2010072296-A1 PYRIDAZINONE DERIVATIVES MERCK PATENT GMBH (DE) 2010-07-01 — — WO disclosed
WO-2009006959-A1 PYRIDAZINONE DERIVATES MERCK PATENT GMBH (DE) 2009-01-15 — — WO disclosed
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