SCHEMBL17201804

SCHEMBL17201804

COc1cnc(C(=O)Nc2c(Cl)c[n+]([O-])cc2Cl)cc1OC1CCC1

nearest known ligand 0.55

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
PDE4D Q08499 15/20 0.55
PDE4A P27815 9/20 0.55
PDE4B Q07343 9/20 0.55
PDE4C Q08493 9/20 0.55
SCN9A Q15858 3/20 0.42
SCN5A Q14524 2/20 0.42
POLB P06746 1/20 0.39
TRPC6 Q9Y210 1/20 0.38

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
SCHEMBL72555 0.86 PDE4D (0.73) PDE4DPDE4APDE4BPDE4C
SCHEMBL70818 0.86 PDE4D (0.61) PDE4DPDE4APDE4BPDE4CPOLB
SCHEMBL71115 0.85 PDE4D (0.71) PDE4DPDE4APDE4BPDE4CPOLB
SCHEMBL71124 0.85 PDE4D (0.60) PDE4DPDE4APDE4BPDE4CPOLB
SCHEMBL71310 0.83 PDE4D (0.60) PDE4DPDE4APDE4BPDE4CPOLB
SCHEMBL1433277 0.83 CNR2 (0.48) PDE4DPDE4APDE4BPDE4C
SCHEMBL29733437 0.83 CNR2 (0.48) PDE4DPDE4APDE4BPDE4C
SCHEMBL71412 0.82 PDE4D (0.55) PDE4DPDE4APDE4BPDE4CPOLB
SCHEMBL71161 0.82 PDE4D (0.62) PDE4DPDE4APDE4BPDE4CPOLB
SCHEMBL69648 0.81 PDE4D (0.55) PDE4DPDE4APDE4BPDE4CPOLB

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2935239-B1 PROCESS FOR PREPARING 4-(CYCLOPROPYLMETHOXY)-N-(3,5-DICHLORO-1-OXIDO-4-PYRIDYL)-5-METHOXYPYRIDINE-2-CARBOXAMIDE SANOFI SA (FR) 2018-08-29 EP disclosed
US-9611250-B2 Process for preparing 4-(cyclopropylmethoxy)-N-(3,5-dichloro-1-oxido-4-pyridyl)-5-methoxypyridine-2-carboxamide SANOFI (FR) 2017-04-04 US disclosed
US-9611250-B2 Process for preparing 4-(cyclopropylmethoxy)-N-(3,5-dichloro-1-oxido-4-pyridyl)-5-methoxypyridine-2-carboxamide SANOFI (FR) 2017-04-04 US disclosed
US-20150307474-A1 PROCESS FOR PREPARING 4-(CYCLOPROPYLMETHOXY)-N-(3,5-DICHLORO-1-OXIDO-4-PYRIDYL)-5-METHOXYPYRIDINE-2-CARBOXAMIDE SANOFI (FR) 2015-10-29 US disclosed
US-20150307474-A1 PROCESS FOR PREPARING 4-(CYCLOPROPYLMETHOXY)-N-(3,5-DICHLORO-1-OXIDO-4-PYRIDYL)-5-METHOXYPYRIDINE-2-CARBOXAMIDE SANOFI (FR) 2015-10-29 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-20150307474-A1 PROCESS FOR PREPARING 4-(CYCLOPROPYLMETHOXY)-N-(3,5-DICHLORO-1-OXIDO-4-PYRIDYL)-5-METHOXYPYRIDINE-2-CARBOXAMIDE CYP3A4, CYP4B1, CYP3A5 PDE4D 341/4885PDE4A 364/4885PDE4B 295/4885

“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.