SCHEMBL497727

SCHEMBL497727

COc1ccc(-c2cn[nH]c(=O)c2)cc1OC1CCCC1

nearest known ligand 0.57

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
PDE4A P27815 16/20 0.57
PDE4B Q07343 13/20 0.57
PDE4C Q08493 13/20 0.57
PDE4D Q08499 13/20 0.57
KCNH2 Q12809 1/20 0.50
HRH3 Q9Y5N1 1/20 0.50
FPR2 P25090 1/20 0.49

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
SCHEMBL498077 0.85 PDE4D (0.48) PDE4APDE4BPDE4CPDE4D
SCHEMBL497977 0.84 PDE4A (0.55) PDE4APDE4BPDE4CPDE4D
SCHEMBL5823060 0.81 PDE4A (0.77) PDE4APDE4BPDE4CPDE4DFPR2
SCHEMBL8632255 0.78 PDE4A (0.71) PDE4APDE4BPDE4CPDE4DHRH3
SCHEMBL127547 0.78 PDE4A (0.50) PDE4APDE4BPDE4CPDE4D
SCHEMBL2372201 0.77 PDE4A (0.61) PDE4APDE4BPDE4CPDE4DFPR2
SCHEMBL8631909 0.77 PDE4A (0.70) PDE4APDE4BPDE4CPDE4DHRH3
SCHEMBL497699 0.77 PDE4A (0.56) PDE4APDE4BPDE4CPDE4DFPR2
SCHEMBL5823404 0.77 PDE4A (0.62) PDE4APDE4BPDE4CPDE4DFPR2
SCHEMBL3375192 0.76 MAPT (0.69) PDE4APDE4BPDE4CPDE4D

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-2157084-B1 5-PHENYL-3-PYRIDAZINONE DERIVATIVE KOWA CO (JP) 2013-05-22 EP disclosed
US-8106053-B2 5-phenyl-3-pyridazinone derivative KOWA COMPANY, LTD. 2012-01-31 US disclosed
US-20100197698-A1 5-PHENYL-3-PYRIDAZINONE DERIVATIVE KOWA COMPANY, LTD. (JP) 2010-08-05 US disclosed
EP-2157084-A1 5-PHENYL-3-PYRIDAZINONE DERIVATIVE Kowa Company, Ltd. (JP) 2010-02-24 EP 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-20100197698-A1 5-PHENYL-3-PYRIDAZINONE DERIVATIVE SERPINE1, MMP1, PLAT PDE4A 2167/4885PDE4B 1932/4885PDE4C 2802/4885

“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.