SCHEMBL2531744

SCHEMBL2531744

CC(C)(C)OC(=O)N1CCC(COc2cnc(-c3cccc(Cn4nc(-c5cccc(C(N)=O)c5)ccc4=O)c3)nc2)CC1

nearest known ligand 0.62

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
▸ MET P08581 12/20 0.62
▸ NQO2 P16083 1/20 0.62
▸ CHEK2 O96017 1/20 0.48
▸ GPR119 Q8TDV5 4/20 0.46
▸ SLC2A1 P11166 1/20 0.43
▸ HDAC1 Q13547 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
SCHEMBL3084089 0.90 MET (0.78) METNQO2GPR119
SCHEMBL2489896 0.90 MET (0.61) METNQO2CHEK2
SCHEMBL2535395 0.90 MET (0.65) METNQO2
SCHEMBL12106973 0.90 MET (0.60) METNQO2GPR119SLC2A1
SCHEMBL2455889 0.89 MET (0.78) METNQO2
SCHEMBL12216835 0.84 MET (0.72) METNQO2
SCHEMBL2455548 0.82 MET (0.79) METNQO2
SCHEMBL12547517 0.81 GPR119 (0.52) METNQO2CHEK2GPR119SLC2A1
SCHEMBL2455804 0.81 MET (0.72) METNQO2
SCHEMBL13181028 0.81 MET (0.60) METNQO2HDAC1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8637518-B2 Pyridazinone derivatives MERCK PATENT GMBH (DE) 2014-01-28 — — US disclosed
US-8637518-B2 Pyridazinone derivatives MERCK PATENT GMBH (DE) 2014-01-28 — — US disclosed
US-8637518-B2 Pyridazinone derivatives MERCK PATENT GMBH (DE) 2014-01-28 — — US disclosed
US-20110257181-A1 PYRIDAZINONE DERIVATIVES MERCK PATENT GESELLSCHAFT MIT BESCHRANKTER HAFTUNG (DE) 2011-10-20 — — US disclosed
US-20110257181-A1 PYRIDAZINONE DERIVATIVES MERCK PATENT GESELLSCHAFT MIT BESCHRANKTER HAFTUNG (DE) 2011-10-20 — — US disclosed
US-20110257181-A1 PYRIDAZINONE DERIVATIVES MERCK PATENT GESELLSCHAFT MIT BESCHRANKTER HAFTUNG (DE) 2011-10-20 — — US 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 (1 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-20110257181-A1 PYRIDAZINONE DERIVATIVES MET, TYRO3, ERBB2 MET 1/4885NQO2 600/4885CHEK2 98/4885

“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.

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