SCHEMBL2514985

SCHEMBL2514985

CC(C)C(Oc1cnc(-c2cccc(Cn3nc(-c4cccc(C#N)c4)ccc3=O)c2)nc1)C1CCNCC1

nearest known ligand 0.66

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
▸ MET P08581 19/20 0.66
▸ NQO2 P16083 1/20 0.66

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
SCHEMBL1296899 0.93 MET (0.68) METNQO2
Hydrochloric Acid SCHEMBL1296470 0.93 MET (0.68) METNQO2
Hydrochloric Acid SCHEMBL1295618 0.93 MET (0.68) METNQO2
Hydrochloric Acid SCHEMBL17823305 0.89 MET (0.65) METNQO2
SCHEMBL2512836 0.88 MET (0.73) METNQO2
SCHEMBL3092215 0.86 MET (0.71) METNQO2
SCHEMBL2462450 0.85 MET (0.82) METNQO2
SCHEMBL30523589 0.85 MET (0.82) METNQO2
SCHEMBL18204293 0.82 MET (0.54) METNQO2
SCHEMBL30002995 0.82 MET (0.70) 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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