SCHEMBL13865477

SCHEMBL13865477

COc1ccc(Cc2ccc(N(C)C(C)C(=O)O)nc2)cc1-c1cccc(Cl)c1

nearest known ligand 0.55

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
PDE4D Q08499 2/20 0.55
PDE4B Q07343 5/20 0.45
CTSA P10619 9/20 0.43
SLC6A9 P48067 2/20 0.41
HTT P42858 1/20 0.39
PTGDR2 Q9Y5Y4 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
SCHEMBL3466496 0.90 PDE4B (0.45) PDE4DPDE4BCTSASLC6A9
SCHEMBL3466491 0.90 PDE4B (0.45) PDE4DPDE4BCTSASLC6A9
SCHEMBL3467286 0.86 PDE4D (0.56) PDE4DPDE4BCTSASLC6A9PTGDR2
SCHEMBL8027459 0.86 PDE4D (0.38) PDE4DPDE4BSLC6A9
SCHEMBL27923754 0.82 CTSA (0.41) PDE4DCTSASLC6A9HTTPTGDR2
SCHEMBL3467205 0.81 PDE4D (0.61) PDE4DPDE4BCTSASLC6A9
SCHEMBL3795872 0.79 PDE4D (0.61) PDE4DPDE4BCTSA
SCHEMBL3788986 0.79 PDE4D (0.58) PDE4DPDE4BCTSA
SCHEMBL3465781 0.79 PDE4D (0.63) PDE4DPDE4BCTSA
SCHEMBL3465831 0.78 SLC6A9 (0.46) PDE4DPDE4BCTSASLC6A9

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2628727-A2 Biaryl PDE4 inhibitors for treating pulmonary and cardiovascular disorders Decode Genetics EHF (IS) 2013-08-21 EP disclosed
US-20120213758-A1 BIARYL PDE4 INHIBITORS FOR TREATING PULMONARY AND CARDIOVASCULAR DISORDERS DeCODE Genetics enf (IS) 2012-08-23 US disclosed
US-20090136473-A1 BIARYL PDE4 INHIBITORS FOR TREATING PULMONARY AND CARDIOVASCULAR DISORDERS DECODE GENETICS EHF (IS) 2009-05-28 US disclosed
US-20090136473-A1 BIARYL PDE4 INHIBITORS FOR TREATING PULMONARY AND CARDIOVASCULAR DISORDERS DECODE GENETICS EHF (IS) 2009-05-28 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-20090136473-A1 BIARYL PDE4 INHIBITORS FOR TREATING PULMONARY AND CARDIOVASCULAR DISORDERS PDE4A, PDE4B, PDE3B PDE4D 7/4885PDE4B 2/4885CTSA 4056/4885
US-20120213758-A1 BIARYL PDE4 INHIBITORS FOR TREATING PULMONARY AND CARDIOVASCULAR DISORDERS PDE4A, PDE4B, PDE3B PDE4D 7/4885PDE4B 2/4885CTSA 4056/4885

“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.