SCHEMBL4960029

SCHEMBL4960029

O=C(Nc1c(Cl)cncc1Cl)C(=O)c1c(Cc2ccc(F)cc2)[nH]c2ccc(O)cc12

nearest known ligand 0.56

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
PDE4A P27815 14/20 0.56
PDE4B Q07343 14/20 0.56
PDE4C Q08493 14/20 0.56
PDE4D Q08499 14/20 0.56
ALOX5 P09917 4/20 0.48
P2RX7 Q99572 1/20 0.41
POLB P06746 1/20 0.39
MAPT P10636 1/20 0.39
SAE1 Q9UBE0 1/20 0.39
UBA2 Q9UBT2 1/20 0.39

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
SCHEMBL6760292 0.86 PDE4A (0.46) PDE4APDE4BPDE4CPDE4DALOX5
SCHEMBL5636904 0.86 PDE4B (0.44) PDE4APDE4BPDE4CPDE4DALOX5
SCHEMBL5533925 0.84 MAPT (0.46) PDE4APDE4BPDE4CPDE4DALOX5
SCHEMBL7675615 0.81 PDE4A (0.46) PDE4APDE4BPDE4CPDE4DALOX5
SCHEMBL5888118 0.77 PDE4A (0.46) PDE4APDE4BPDE4CPDE4DALOX5
SCHEMBL13111735 0.73 PDE4A (0.63) PDE4APDE4BPDE4CPDE4DP2RX7
Awd-12-281 SCHEMBL155120 0.72 PDE4A (1.00) PDE4APDE4BPDE4CPDE4DP2RX7
Awd-12-281 SCHEMBL29413256 0.72 PDE4A (1.00) PDE4APDE4BPDE4CPDE4DP2RX7
SCHEMBL5532547 0.72 MAPT (0.45) POLBMAPTSAE1UBA2
Awd-12-281 SCHEMBL5638122 0.71 PDE4A (0.98) PDE4APDE4BPDE4CPDE4DPOLB

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1526870-A1 NOVEL COMBINATION OF GLUCOCORTICOIDS AND PDE-4-INHIBITORS FOR TREATING RESPIRATORY DISEASES, ALLERGIC DISEASES, ASTHMA AND COPD VIATRIS GmbH & Co. KG (DE) 2005-05-04 EP claimed
US-20040220183-A1 inhibiting tumor necrosis factor; respiratory system disorders; prevent neutrophil infiltration in lungs; skin disorders HOFGEN NORBERT (DE) 2004-11-04 US claimed
EP-1404369-A1 COMPOSITION COMPRISING A PDE-4 INHIBITOR AND H1-RECEPTOR ANTAGONIST AND THE USE THEREOF FOR THE MANUFACTURE OF A MEDICAMENT FOR THE TREATMENT OF RESPIRATORY DISEASES GLAXO GROUP LIMITED (GB) 2004-04-07 EP claimed
WO-2004019984-A1 NOVEL COMBINATION OF GLUCOCORTICOIDS AND PDE-4-INHIBITORS FOR TREATING RESPIRATORY DISEASES, ALLERGIC DISEASES, ASTHMA AND COPD VIATRIS GMBH & CO. KG (DE) 2004-03-11 WO claimed
WO-2003000289-A1 COMPOSITION COMPRISING A PDE-4 INHIBITOR AND H1-RECEPTOR ANTAGONIST AND THE USE THEREOF FOR THE MANUFACTURE OF A MEDICAMENT FOR THE TREATMENT OF RESPIRATORY DISEASES GLAXO GROUP LIMITED (GB) 2003-01-03 WO claimed
EP-3039126-A2 SMALL MOLECULE CELLULAR REPROGRAMMING TO GENERATE NEURONAL CELLS The J. David Gladstone Institutes, A Testamentary Trust Established under The Will of J. David Gladstone (US) 2016-07-06 EP disclosed
WO-2015041809-A2 SMALL MOLECULE CELLULAR REPROGRAMMING TO GENERATE NEURONAL CELLS THE J. DAVID GLADSTONE INSTITUTES, A TESTAMENTARY TRUST ESTABLISHED UNDER THE WILL OF J. DAVID GLADSTONE (US) 2015-03-26 WO disclosed
EP-2736886-A1 SUBSTITUTED QUINOLINES AND THEIR USE AS MEDICAMENTS Boehringer Ingelheim International GmbH (DE) 2014-06-04 EP disclosed
WO-2013014060-A1 SUBSTITUTED QUINOLINES AND THEIR USE AS MEDICAMENTS BOEHRINGER INGELHEIM INTERNATIONAL GMBH (DE) 2013-01-31 WO disclosed
EP-1888033-A2 METHOD AND COMPOSITION FOR TREATING INFLAMMATORY DISORDERS Biolipox AB (SE) 2008-02-20 EP disclosed
WO-2007123699-A1 METHODS AND COMPOSITIONS FOR MODULATING MELANOGENESIS BY USING A MCLR AGONIST DANA-FARBER CANCER INSTITUTE, INC. (US) 2007-11-01 WO disclosed
WO-2006131737-A2 METHOD AND COMPOSITION FOR TREATING INFLAMMATORY DISORDERS BIOLIPOX AB (SE) 2006-12-14 WO disclosed
WO-2006062817-A2 COMPOSITIONS AND METHODS FOR THE TREATMENT OF PERIPHERAL B-CELL NEOPLASMS BOSTON MEDICAL CENTER CORPORATION (US) 2006-06-15 WO disclosed
EP-1660086-A2 COMBINATION OF GH SECRETAGOGUES AND PDE4 INHIBITORS FOR THE TREATMENT OF ALZHEIMER'S DISEASE MERCK SHARP & DOHME LTD. (GB) 2006-05-31 EP disclosed
EP-1526870-A1 NOVEL COMBINATION OF GLUCOCORTICOIDS AND PDE-4-INHIBITORS FOR TREATING RESPIRATORY DISEASES, ALLERGIC DISEASES, ASTHMA AND COPD VIATRIS GmbH & Co. KG (DE) 2005-05-04 EP disclosed
WO-2004087157-A2 COMBINATION OF GH SECRETAGOGUES AND PDE4 INHIBITORS FOR THE TREATMENT OF ALZHEIMER'S DISEASE MERCK SHARP & DOHME LIMITED (GB) 2004-10-14 WO disclosed
WO-2004019984-A1 NOVEL COMBINATION OF GLUCOCORTICOIDS AND PDE-4-INHIBITORS FOR TREATING RESPIRATORY DISEASES, ALLERGIC DISEASES, ASTHMA AND COPD VIATRIS GMBH & CO. KG (DE) 2004-03-11 WO 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-20040220183-A1 inhibiting tumor necrosis factor; respiratory system disorders; prevent neutrophil infiltration in lungs; skin disorders MMP8, MPO, TNF PDE4A 7/4885PDE4B 21/4885PDE4C 60/4885

“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.