SCHEMBL1320728

SCHEMBL1320728

CC(C)(C)OC(=O)N1CCC(n2cc(-c3cnc(-c4cccc(Cn5nc(Oc6ccccc6)ccc5=O)c4)nc3)cn2)CC1

nearest known ligand 0.47

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
MET P08581 9/20 0.47
TNK2 Q07912 1/20 0.46
RET P07949 2/20 0.42
HPGDS O60760 2/20 0.41
FGFR1 P11362 2/20 0.41
FGFR2 P21802 2/20 0.41
FGFR4 P22455 2/20 0.41
FGFR3 P22607 2/20 0.41
KDR P35968 2/20 0.41
FLT3 P36888 2/20 0.41
NQO2 P16083 1/20 0.38
TTK P33981 1/20 0.38
GPR119 Q8TDV5 1/20 0.38
USP30 Q70CQ3 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
SCHEMBL2474231 0.91 MET (0.44) METTNK2RETNQO2
SCHEMBL3098728 0.88 MET (0.48) METTNK2RETHPGDSFGFR1
SCHEMBL1320797 0.87 MET (0.51) METTNK2RETHPGDSFGFR3
SCHEMBL1318277 0.86 MAP4K3 (0.47) METNQO2
SCHEMBL13152207 0.85 MET (0.55) MET
Hydrochloric Acid SCHEMBL1317215 0.85 MAP4K3 (0.46) MET
SCHEMBL1321592 0.82 MET (0.52) METTNK2RETHPGDSFGFR1
SCHEMBL12547684 0.81 MET (0.52) METTNK2RETHPGDSFGFR1
SCHEMBL15431645 0.81 MET (0.51) METTNK2RETHPGDSFGFR1
SCHEMBL13089764 0.79 MET (0.49) MET

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-9376426-B2 Pyridazinone derivatives MERCK PATENT GMBH (DE) 2016-06-28 US disclosed
US-9376426-B2 Pyridazinone derivatives MERCK PATENT GMBH (DE) 2016-06-28 US disclosed
US-9376426-B2 Pyridazinone derivatives MERCK PATENT GMBH (DE) 2016-06-28 US disclosed
US-8853211-B2 Pyridazinone derivatives MERCK PATENT GMBH (DE) 2014-10-07 US disclosed
US-8853211-B2 Pyridazinone derivatives MERCK PATENT GMBH (DE) 2014-10-07 US disclosed
US-8853211-B2 Pyridazinone derivatives MERCK PATENT GMBH (DE) 2014-10-07 US disclosed
US-20140148463-A1 PYRIDAZINONE DERIVATIVES MERCK PATENT GMBH (DE) 2014-05-29 US disclosed
US-20140148463-A1 PYRIDAZINONE DERIVATIVES MERCK PATENT GMBH (DE) 2014-05-29 US disclosed
US-20140148463-A1 PYRIDAZINONE DERIVATIVES MERCK PATENT GMBH (DE) 2014-05-29 US disclosed
EP-2373644-B1 PYRIDAZINONE DERIVATIVES MERCK PATENT GMBH (DE) 2012-10-24 EP disclosed
US-20110269765-A1 Pyridazinone derivatives MERCK PATENT GMBH (DE) 2011-11-03 US disclosed
US-20110269765-A1 Pyridazinone derivatives MERCK PATENT GMBH (DE) 2011-11-03 US disclosed
US-20110269765-A1 Pyridazinone derivatives MERCK PATENT GMBH (DE) 2011-11-03 US disclosed
WO-2010078910-A1 PYRIDAZINONE DERIVATIVES MERCK PATENT GMBH (DE) 2010-07-15 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-20140148463-A1 PYRIDAZINONE DERIVATIVES MET, RET, ERBB2 MET 1/4885TNK2 677/4885RET 2/4885
US-20110269765-A1 Pyridazinone derivatives MET, RET, ERBB2 MET 1/4885TNK2 677/4885RET 2/4885

“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.