SCHEMBL2480684

SCHEMBL2480684

N#Cc1cccc(-c2ccc(=O)n(Cc3cccc(-c4ncc(OCC5CCN(C(=O)O)CC5)cn4)c3)n2)c1

nearest known ligand 0.82

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
▸ MET P08581 17/20 0.82
▸ NQO2 P16083 1/20 0.82
▸ MGLL Q99685 1/20 0.42

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
SCHEMBL30905887 0.93 MET (0.80) METNQO2
SCHEMBL29223103 0.91 MET (0.80) METNQO2
SCHEMBL2480686 0.91 MET (0.80) METNQO2
SCHEMBL31690377 0.91 MET (0.80) METNQO2
SCHEMBL29222978 0.91 MET (0.74) METNQO2MGLL
Tepotinib SCHEMBL29379106 0.90 MET (1.00) METNQO2
Tepotinib SCHEMBL1296895 0.90 MET (1.00) METNQO2
SCHEMBL3084089 0.90 MET (0.78) METNQO2
SCHEMBL31690421 0.90 MET (0.80) METNQO2
Tepotinib SCHEMBL1295616 0.89 MET (0.98) 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 4 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2754660-B1 Pyridazinone derivatives MERCK PATENT GMBH (DE) 2016-11-02 — — EP claimed
EP-2164843-B1 PYRIDAZINONE DERIVATES MERCK PATENT GMBH (DE) 2014-10-29 — — EP claimed
EP-2373640-A1 NOVEL POLYMORPHIC FORMS OF 3-(1-{3-[5-(1-METHYL-PIPERIDIN-4YLMETHOXY)-PYRIMIDIN-2-YL]-BENZYL}-6-OXO-1,6-DIHYDRO-PYRIDAZIN-3-YL)-BENZONITRILE HYDROCHLORIDE SALT AND PROCESSES OF MANUFACTURING THEREOF Merck Patent GmbH (DE) 2011-10-12 — — EP disclosed
WO-2010078897-A1 NOVEL POLYMORPHIC FORMS OF 3-(1-{3-[5-(1-METHYL-PIPERIDIN-4YLMETHOXY)-PYRIMIDIN-2-YL]-BENZYL}-6-OXO-1,6-DIHYDRO-PYRIDAZIN-3-YL)-BENZONITRILE HYDROCHLORIDE SALT AND PROCESSES OF MANUFACTURING THEREOF MERCK PATENT GMBH (DE) 2010-07-15 — — WO disclosed
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