SCHEMBL6438420

SCHEMBL6438420

C[C@H](C#Cc1ccc(Oc2ccc(F)cc2)o1)N(O)C(N)=O

nearest known ligand 1.00 ✓ in ChEMBL — recovers established targets

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
ALOX5 P09917 19/20 1.00
EPHX2 P34913 2/20 0.49
ACACB O00763 1/20 0.44
ACACA Q13085 1/20 0.44

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
SCHEMBL8590069 1.00 ALOX5 (1.00) ALOX5EPHX2ACACBACACA
SCHEMBL1807930 1.00 ALOX5 (1.00) ALOX5EPHX2ACACBACACA
SCHEMBL9048729 0.94 ALOX5 (0.88) ALOX5EPHX2
SCHEMBL12420450 0.91 ALOX5 (0.83) ALOX5EPHX2
SCHEMBL13140099 0.91 ALOX5 (0.83) ALOX5EPHX2
SCHEMBL9047929 0.90 ALOX5 (0.81) ALOX5EPHX2ACACBACACA
SCHEMBL9047669 0.90 ALOX5 (0.81) ALOX5EPHX2ACACBACACA
SCHEMBL9049110 0.89 ALOX5 (0.80) ALOX5EPHX2ACACBACACA
SCHEMBL9049256 0.89 ALOX5 (0.80) ALOX5EPHX2ACACBACACA
SCHEMBL9047887 0.89 ALOX5 (0.80) ALOX5EPHX2ACACBACACA

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-1998058644-A1 (S)-(-)-N-[3- [5-(4-FLUOROPHENOXY) -2-FURANYL]-1-METHYL -2-PROPYNYL]-N-HYDROXYUREA SEPRACOR, INC. (US) 1998-12-30 WO claimed
US-7563790-B2 Pyridazine derivatives MERCK PATENT GMBH (DE) 2009-07-21 US disclosed
US-7354941-B2 Nicotinamide benzofused-heterocyclyl derivatives useful as selective inhibitors of PDE4 isozymes PFIZER PRODUCTS INC. (US) 2008-04-08 US disclosed
US-7250518-B2 Nicotinamide acids, amides, and their mimetics active as inhibitors of PDE4 isozymes PFIZER INC. (US) 2007-07-31 US disclosed
US-20070161681-A1 ETHER DERIVATIVES USEFUL AS INHIBITORS OF PDE4 ISOZYMES PFIZER INC. (US) 2007-07-12 US disclosed
US-7183293-B2 Ether derivatives useful as inhibitors of PDE4 isozymes PFIZER INC. (US) 2007-02-27 US disclosed
US-20050222193-A1 Novel combination for the treatment of airway disorders ALTANA PHARMA AG (DE) 2005-10-06 US disclosed
WO-2005074932-A1 THE USE OF (S) - PANTOPRAZOLE MAGNESIUM FOR THE TREATMENT OF AIRWAY DISORDERS ALTANA PHARMA AG (DE) 2005-08-18 WO disclosed
CN-1652822-A New combination of reversible proton pump inhibitors and airway therapeutics for treating airway disorders ALTANA PHARMA AG (DE) 2005-08-10 CN disclosed
US-20050165041-A1 Combination for the treatment of airway disorders ALTANA PHARMA AG (DE) 2005-07-28 US disclosed
EP-1517706-A2 COMBINATION OF A PROTON PUMP INHIBITOR AND A RESPIRATORY AGENT FOR THE TREATMENT OF RESPIRATORY DISEASES ALTANA Pharma AG (DE) 2005-03-30 EP disclosed
WO-2003094968-A2 COMBINATION OF A PROTON PUMP INHIBITOR AND A RESPIRATORY AGENT FOR THE TREATMENT OF RESPIRATORY DISEASES ALTANA PHARMA AG (DE) 2003-11-20 WO disclosed
WO-1998058644-A1 (S)-(-)-N-[3- [5-(4-FLUOROPHENOXY) -2-FURANYL]-1-METHYL -2-PROPYNYL]-N-HYDROXYUREA SEPRACOR, INC. (US) 1998-12-30 WO disclosed
US-5591451-A SUSTAINED RELEASE; STABILITY ABBOTT LABORATORIES (US) 1997-01-07 US disclosed
WO-1995005808-A1 OIL-BASED TABLETING METHOD ABBOTT LABORATORIES (US) 1995-03-02 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-20070161681-A1 ETHER DERIVATIVES USEFUL AS INHIBITORS OF PDE4 ISOZYMES PDE4A, PDE4B, PDE4D ALOX5 700/4885EPHX2 134/4885ACACB 3067/4885

“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.