SCHEMBL185643

SCHEMBL185643

O=C(Nc1c(Cl)c[n+]([O-])cc1Cl)c1ccc(OC(F)F)c(OCC2CC2)c1

nearest known ligand 0.76

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
PDE4B Q07343 20/20 0.76
PDE4A P27815 18/20 0.76
PDE4C Q08493 18/20 0.76
PDE4D Q08499 18/20 0.76
ABCB11 O95342 1/20 0.76

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
SCHEMBL15908883 0.91 PDE4B (0.77) PDE4BPDE4APDE4CPDE4DABCB11
SCHEMBL12316203 0.88 PDE4B (0.81) PDE4BPDE4APDE4CPDE4DABCB11
Roflumilast SCHEMBL19158 0.86 PDE4B (1.00) PDE4BPDE4APDE4CPDE4DABCB11
Roflumilast SCHEMBL18095182 0.86 PDE4B (1.00) PDE4BPDE4APDE4CPDE4DABCB11
Roflumilast SCHEMBL29349467 0.86 PDE4B (1.00) PDE4BPDE4APDE4CPDE4DABCB11
Roflumilast SCHEMBL29033058 0.85 PDE4B (0.98) PDE4BPDE4APDE4CPDE4DABCB11
Roflumilast SCHEMBL29039838 0.85 PDE4B (0.98) PDE4BPDE4APDE4CPDE4DABCB11
Roflumilast SCHEMBL28150332 0.85 PDE4B (0.98) PDE4BPDE4APDE4CPDE4DABCB11
Roflumilast SCHEMBL29191360 0.85 PDE4B (0.96) PDE4BPDE4APDE4CPDE4DABCB11
Roflumilast SCHEMBL20677818 0.85 PDE4B (0.96) PDE4BPDE4APDE4CPDE4DABCB11

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 736 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-111904962-A Pharmaceutical composition containing PDE4 inhibitor and PI3 or dual PI 3-gamma kinase inhibitor 理森制药股份公司 2020-11-10 CN claimed
US-20200237735-A1 PHARMACEUTICAL COMPOSITIONS CONTAINING A PDE4 INHIBITOR AND A P13 DELTA OR DUAL P13 DELTA-GAMMA KINASE INHIBITOR RHIZEN PHARMACEUTICALS AG (CH) 2020-07-30 US claimed
US-10058539-B2 Pharmaceutical compositions containing a PDE4 inhibitor and a PI3 delta or dual PI3 delta-gamma kinase inhibitor RHIZEN PHARMACEUTICALS SA (CH) 2018-08-28 US claimed
US-20170319558-A1 PHARMACEUTICAL COMPOSITIONS CONTAINING A PDE4 INHIBITOR AND A PI3 DELTA OR DUAL PI3 DELTA-GAMMA KINASE INHIBITOR RHIZEN PHARMACEUTICALS AG (CH) 2017-11-09 US claimed
US-9737521-B2 Pharmaceutical compositions containing a PDE4 inhibitor and a PI3 delta or dual PI3 delta-gamma kinase inhibitor RHIZEN PHARMACEUTICALS SA (CH) 2017-08-22 US claimed
US-20150272936-A1 PHARMACEUTICAL COMPOSITIONS CONTAINING A PDE4 INHIBITOR AND A PI3 DELTA OR DUAL PI3 DELTA-GAMMA KINASE INHIBITOR RHIZEN PHARMACEUTICALS AG (CH) 2015-10-01 US claimed
EP-2916868-A1 PHARMACEUTICAL COMPOSITIONS CONTAINING A PDE4 INHIBITOR AND A PI3 DELTA OR DUAL PI3 DELTA-GAMMA KINASE INHIBITOR Rhizen Pharmaceuticals S.A. (CH) 2015-09-16 EP claimed
WO-2014072937-A1 PHARMACEUTICAL COMPOSITIONS CONTAINING A PDE4 INHIBITOR AND A PI3 DELTA OR DUAL PI3 DELTA-GAMMA KINASE INHIBITOR RHIZEN PHARMACEUTICALS SA (CH) 2014-05-15 WO claimed
EP-1628682-B1 COMPOSITION COMPRISING A PDE4 INHIBITOR AND A PDE5 INHIBITOR FOR THE TREATMENT OF COPD TAKEDA GMBH (DE) 2013-09-25 EP claimed
EP-2598145-A1 PHARMACEUTICAL COMPOSITION FOR TREATMENT OF RESPIRATORY AND INFLAMMATORY DISEASES Boehringer Ingelheim International GmbH (DE) 2013-06-05 EP claimed
WO-2004084894-A1 SYNERGISTIC COMBINATION COMPRISING ROFLUMILAST AND REVATROPATE FOR THE TREATMENT OF RESPIRATORY DISEASES ALTANA PHARMA AG (DE) 2004-10-07 WO claimed
WO-2004084897-A1 SYNERGISTIC COMBINATION COMPRISING ROFLUMILAST AND AN ANTICHOLINERGIC AGENT SELECTED FROM IPRATROPIUM, OXITROPIUM AND TIOTROPIUM SALTS FOR THE TREATMENT OF RESPIRATORY DISEASES ALTANA PHARMA AG (DE) 2004-10-07 WO claimed
WO-2004084896-A1 SYNERGISTIC COMBINATION COMPRISING ROFLUMILAST AND AN ANTICHOLINERGIC AGENT SELECTED FROM IPRATROPIUM, OXITROPIUM AND TIOTROPIUM SALTS FOR THE TREATMENT OF RESPIRATORY DISEASES ALTANA PHARMA AG (DE) 2004-10-07 WO claimed
WO-2004062671-A2 PDE4 INHIBITORS FOR THE TREATMENT OF NEOPLASMS OF LYMPHOID CELLS ALTANA PHARMA AG (DE) 2004-07-29 WO claimed
US-20040058950-A1 Pharmaceutical compositions based on anticholinergics and PDE-IV inhibitors BOEHRINGER INGELHEIM PHARMA GMBH & CO. KG (DE) 2004-03-25 US claimed
WO-2004004704-A1 NOVEL PHARMACEUTICAL COMPOSITIONS COMPRISING NOVEL ANTICHOLINERGIC AGENTS AND PDE-IV INHIBITORS BOEHRINGER INGELHEIM PHARMA GMBH & CO. KG (DE) 2004-01-15 WO claimed
US-6531493-B1 3-cyclopropylmethoxy-4-difluoromethoxy-N-(3,5-dichloropyrid-4-yl)benzamide in the treatment of multiple sclerosis ALTANA PHARMA AG (DE) 2003-03-11 US claimed
JP-2002538207-A 2002-11-12 JP claimed
EP-1161239-A2 3-CYCLOPROPYLMETHOXY-4-DIFLUOROMETHOXY-N-(3,5-DICHLOROPYRID-4-YL)BENZAMIDE IN THE TREATMENT OF MULTIPLE SCLEROSIS Byk Gulden Lomberg Chemische Fabrik GmbH (DE) 2001-12-12 EP claimed
WO-2000053182-A2 3-CYCLOPROPYLMETHOXY-4-DIFLUOROMETHOXY-N-(3,5-DICHLOROPYRID-4-YL)BENZAMIDE IN THE TREATMENT OF MULTIPLE SCLEROSIS BYK GULDEN LOMBERG CHEMISCHE FABRIK GMBH (DE) 2000-09-14 WO claimed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (5 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-20040058950-A1 Pharmaceutical compositions based on anticholinergics and PDE-IV inhibitors PDE4B, PDE4A, PDE3B PDE4B 1/4885PDE4A 2/4885PDE4C 4/4885
US-20170319558-A1 PHARMACEUTICAL COMPOSITIONS CONTAINING A PDE4 INHIBITOR AND A PI3 DELTA OR DUAL PI3 DELTA-GAMMA KINASE INHIBITOR PIK3CD, PIK3R4, PIK3CG PDE4B 6/4885PDE4A 5/4885PDE4C 10/4885
US-20200237735-A1 PHARMACEUTICAL COMPOSITIONS CONTAINING A PDE4 INHIBITOR AND A P13 DELTA OR DUAL P13 DELTA-GAMMA KINASE INHIBITOR PDE4A, PDE12, PDE4B PDE4B 3/4885PDE4A 1/4885PDE4C 8/4885
US-20150272936-A1 PHARMACEUTICAL COMPOSITIONS CONTAINING A PDE4 INHIBITOR AND A PI3 DELTA OR DUAL PI3 DELTA-GAMMA KINASE INHIBITOR PIK3CD, PIK3R4, PIK3CG PDE4B 6/4885PDE4A 5/4885PDE4C 10/4885
US-10058539-B2 Pharmaceutical compositions containing a PDE4 inhibitor and a PI3 delta or dual PI3 delta-gamma kinase inhibitor PIK3CD, PIK3R4, PIK3CG PDE4B 6/4885PDE4A 5/4885PDE4C 10/4885

“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.