SCHEMBL498002

SCHEMBL498002

COc1ccc(-c2cnn(C)c(=O)c2)cc1O[C@@H]1CCOC1

nearest known ligand 0.47

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
PDE4A P27815 14/20 0.47
PDE4D Q08499 11/20 0.47
PDE4B Q07343 9/20 0.47
PDE4C Q08493 7/20 0.47
PDE3B Q13370 2/20 0.47
PDE10A Q9Y233 2/20 0.47
PAX8 Q06710 1/20 0.45

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
SCHEMBL497851 1.00 PDE4A (0.47) PDE4APDE4DPDE4BPDE4CPDE3B
SCHEMBL497850 1.00 PDE4A (0.47) PDE4APDE4DPDE4BPDE4CPDE3B
SCHEMBL497699 0.85 PDE4A (0.56) PDE4APDE4DPDE4BPDE4C
SCHEMBL498060 0.85 PDE4A (0.47) PDE4APDE4DPDE4BPDE4CPDE3B
SCHEMBL497846 0.85 PDE4A (0.47) PDE4APDE4DPDE4BPDE4CPDE3B
SCHEMBL497845 0.85 PDE4A (0.47) PDE4APDE4DPDE4BPDE4CPDE3B
SCHEMBL497890 0.81 PDE4B (0.57) PDE4APDE4DPDE4BPDE4C
SCHEMBL498077 0.80 PDE4D (0.48) PDE4APDE4DPDE4BPDE4CPDE3B
SCHEMBL3373175 0.75 PDE4D (0.50) PDE4APDE4DPDE4BPDE4CPDE3B
SCHEMBL497992 0.74 PDE4D (0.46) PDE4APDE4DPDE4BPDE4C

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 2167/4885PDE4D 2002/4885PDE4B 1932/4885

“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.