SCHEMBL3098728

SCHEMBL3098728

CC(C)(C)OC(=O)N1CCC(n2cc(-c3cnc(-c4cccc(Cn5nc(C6CC6)ccc5=O)c4)nc3)cn2)CC1

nearest known ligand 0.48

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
MET P08581 10/20 0.48
FGFR1 P11362 2/20 0.42
FGFR2 P21802 2/20 0.42
FGFR4 P22455 2/20 0.42
FGFR3 P22607 2/20 0.42
KDR P35968 2/20 0.42
FLT3 P36888 2/20 0.42
RET P07949 2/20 0.41
HPGDS O60760 2/20 0.41
NQO2 P16083 1/20 0.40
DDB1 Q16531 1/20 0.40
CRBN Q96SW2 1/20 0.40
TTK P33981 1/20 0.40
TNK2 Q07912 1/20 0.39

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
SCHEMBL1581181 0.90 MET (0.47) METFGFR1FGFR2FGFR3NQO2
SCHEMBL13152207 0.89 MET (0.55) MET
SCHEMBL1320728 0.88 MET (0.47) METFGFR1FGFR2FGFR4FGFR3
SCHEMBL1320797 0.87 MET (0.51) METFGFR3KDRRETHPGDS
SCHEMBL1581098 0.84 MET (0.49) METFGFR1FGFR2FGFR3
SCHEMBL1321592 0.84 MET (0.52) METFGFR1FGFR2FGFR4FGFR3
SCHEMBL12547684 0.83 MET (0.52) METFGFR1FGFR2FGFR4FGFR3
SCHEMBL13089764 0.83 MET (0.49) MET
SCHEMBL3083794 0.82 MET (0.53) MET
SCHEMBL15431645 0.80 MET (0.51) METFGFR1FGFR2FGFR4FGFR3

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8859547-B2 Pyridazinone derivatives MERCK PATENT GMBH (DE) 2014-10-14 US disclosed
US-8859547-B2 Pyridazinone derivatives MERCK PATENT GMBH (DE) 2014-10-14 US disclosed
US-8859547-B2 Pyridazinone derivatives MERCK PATENT GMBH (DE) 2014-10-14 US disclosed
CN-101903374-B 2-benzylpyridazinone derivatives as MET kinase inhibitors MERCK PATENT GMBH 2013-12-18 CN disclosed
US-8557813-B2 2-benzylpyridazinone derivatives as met kinase inhibitors MERCK PATENT GMBH (DE) 2013-10-15 US disclosed
US-8557813-B2 2-benzylpyridazinone derivatives as met kinase inhibitors MERCK PATENT GMBH (DE) 2013-10-15 US disclosed
US-8557813-B2 2-benzylpyridazinone derivatives as met kinase inhibitors MERCK PATENT GMBH (DE) 2013-10-15 US disclosed
US-20130190311-A1 Pyridazinone derivatives MERCK PATENT GMBH (DE) 2013-07-25 US disclosed
US-20130190311-A1 Pyridazinone derivatives MERCK PATENT GMBH (DE) 2013-07-25 US disclosed
US-20130190311-A1 Pyridazinone derivatives MERCK PATENT GMBH (DE) 2013-07-25 US disclosed
EP-2220070-B1 2-BENZYLPYRIDAZINONE DERIVATIVES AS MET KINASE INHIBITORS MERCK PATENT GMBH (DE) 2011-04-20 EP disclosed
CN-101903374-A 2-benzylpyridazinone derivatives as met kinase inhibitors MERCK PATENT GMBH 2010-12-01 CN disclosed
US-20100273796-A1 2-BENZYLPYRIDAZINONE DERIVATIVES AS MET KINASE INHIBITORS MERCK PATENT GESELLSCHAFT MIT BESCHRANKTER HAFTUNG (DE) 2010-10-28 US disclosed
US-20100273796-A1 2-BENZYLPYRIDAZINONE DERIVATIVES AS MET KINASE INHIBITORS MERCK PATENT GESELLSCHAFT MIT BESCHRANKTER HAFTUNG (DE) 2010-10-28 US disclosed
US-20100273796-A1 2-BENZYLPYRIDAZINONE DERIVATIVES AS MET KINASE INHIBITORS MERCK PATENT GESELLSCHAFT MIT BESCHRANKTER HAFTUNG (DE) 2010-10-28 US disclosed
WO-2009083076-A1 2-BENZYLPYRIDAZINONE DERIVATIVES AS MET KINASE INHIBITORS MERCK PATENT GMBH (DE) 2009-07-09 WO disclosed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (2 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.

PatentTitleText reads most aboutPredicted target · text-rank
US-20100273796-A1 2-BENZYLPYRIDAZINONE DERIVATIVES AS MET KINASE INHIBITORS ERBB2, RET, MET MET 3/4885FGFR1 150/4885FGFR2 190/4885
US-20130190311-A1 Pyridazinone derivatives MET, RET, ERBB2 MET 1/4885FGFR1 86/4885FGFR2 288/4885

“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.