SCHEMBL19283081

SCHEMBL19283081

COc1cc(-c2cc(C(F)(F)F)c(=O)[nH]n2)ccc1OC(F)F

nearest known ligand 0.69

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PDE4A P27815 6/20 0.69
PDE4B Q07343 6/20 0.69
PDE4C Q08493 6/20 0.69
PDE4D Q08499 6/20 0.69
SMN1; SMN2 Q16637 5/20 0.69
PDE3B Q13370 3/20 0.69
PDE3A Q14432 3/20 0.69
MAPK1 P28482 3/20 0.69
HPGD P15428 3/20 0.69
CYP1A2 P05177 2/20 0.69
CYP2C9 P11712 2/20 0.69
CYP2C19 P33261 2/20 0.69
LMNA P02545 2/20 0.69
TP53 P04637 2/20 0.69
TSHR P16473 1/20 0.69
BLM P54132 1/20 0.69
PMP22 Q01453 1/20 0.69
MAPT P10636 7/20 0.44
KMT2A Q03164 6/20 0.43
MEN1 O00255 5/20 0.43

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
SCHEMBL29892342 1.00 PDE4A (0.69) PDE4APDE4BPDE4CPDE4DSMN1; SMN2
SCHEMBL19283074 0.90 PDE4A (0.62) PDE4APDE4BPDE4CPDE4DSMN1; SMN2
Zardaverine SCHEMBL15263214 0.82 PDE4A (1.00) PDE4APDE4BPDE4CPDE4DSMN1; SMN2
Zardaverine SCHEMBL29388700 0.82 PDE4A (1.00) PDE4APDE4BPDE4CPDE4DSMN1; SMN2
Zardaverine SCHEMBL13334 0.82 PDE4A (1.00) PDE4APDE4BPDE4CPDE4DSMN1; SMN2
SCHEMBL19283072 0.80 MAPK1 (0.41) PDE4APDE4BPDE4CPDE4DSMN1; SMN2
SCHEMBL14910704 0.78 PDE4D (0.67) PDE4APDE4BPDE4CPDE4DSMN1; SMN2
SCHEMBL10779323 0.77 PDE4A (1.00) PDE4APDE4BPDE4CPDE4DSMN1; SMN2
SCHEMBL1769751 0.73 PDE4A (0.70) PDE4APDE4BPDE4CPDE4DSMN1; SMN2
SCHEMBL23409918 0.73 PDE4D (0.48) PDE4APDE4BPDE4CPDE4DSMN1; SMN2

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
US-20170247335-A1 FLUORINATED PYRIDAZIN-3-ONES FOR THE USE THEREOF IN THE TREATMENT OF LUNG DISEASES INSERM (INSTITUT NATIONAL DE LA SANTE ET DE LA RECHERCHE MEDICALE) (FR) 2017-08-31 US claimed
US-20230013304-A1 N2-ARYLMETHYL-4-HALOALKYL-PYRIDAZIN-3-ONE CFTR MODULATORS FOR THE TREATMENT OF CYSTIC FIBROSIS ECOLE NORMALE SUPERIEURE DE LYON (FR) 2023-01-19 US disclosed
CN-114945368-A N2-arylmethyl-4-haloalkyl-pyridazin-3-one compounds and uses thereof 香槟-阿尔登兰斯大学 2022-08-26 CN disclosed
WO-2021105641-A1 N2-ARYLMETHYL-4-HALOALKYL-PYRIDAZIN-3-ONE CFTR MODULATORS FOR THE TREATMENT OF CYSTIC FIBROSIS UNIVERSITE DE REIMS CHAMPAGNE-ARDENNE (FR) 2021-06-03 WO disclosed
US-20170247335-A1 FLUORINATED PYRIDAZIN-3-ONES FOR THE USE THEREOF IN THE TREATMENT OF LUNG DISEASES INSERM (INSTITUT NATIONAL DE LA SANTE ET DE LA RECHERCHE MEDICALE) (FR) 2017-08-31 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 (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-20230013304-A1 N2-ARYLMETHYL-4-HALOALKYL-PYRIDAZIN-3-ONE CFTR MODULATORS FOR THE TREATMENT OF CYSTIC FIBROSIS CFTR, CLCN2, SCNN1B PDE4A 513/4885PDE4B 712/4885PDE4C 763/4885
US-20170247335-A1 FLUORINATED PYRIDAZIN-3-ONES FOR THE USE THEREOF IN THE TREATMENT OF LUNG DISEASES PEX3, NCOA3, NCAPD3 PDE4A 2836/4885PDE4B 3398/4885PDE4C 3502/4885

“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.