SCHEMBL14009706

SCHEMBL14009706

CN(C)CCS(=O)(=O)c1ccc(N2C[C@@H](c3ccc(Cl)c(Oc4c(Cl)cccc4C#N)c3)CC2=O)cc1C(N)=O

nearest known ligand 0.34

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
PDE4A P27815 2/20 0.34
PDE4B Q07343 2/20 0.34
PDE4C Q08493 2/20 0.34
PDE4D Q08499 2/20 0.34
POLB P06746 1/20 0.33
MEN1 O00255 1/20 0.30
ALDH1A1 P00352 1/20 0.30
KMT2A Q03164 1/20 0.30

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
SCHEMBL13923091 0.85 PDE4A (0.41) PDE4APDE4BPDE4CPDE4DMEN1
SCHEMBL14009738 0.83 PDE4A (0.37) PDE4APDE4BPDE4CPDE4DPOLB
SCHEMBL4191952 0.83 PDE4A (0.37) PDE4APDE4BPDE4CPDE4DPOLB
SCHEMBL4199728 0.83 PDE4A (0.39) PDE4APDE4BPDE4CPDE4DPOLB
SCHEMBL4183683 0.83 PDE4A (0.39) PDE4APDE4BPDE4CPDE4DPOLB
SCHEMBL14035996 0.82 PRSS12 (0.39) PDE4APDE4BPDE4CPDE4DPOLB
SCHEMBL13922962 0.81 PDE4A (0.43) PDE4APDE4BPDE4CPDE4DPOLB
SCHEMBL13923086 0.80 PDE4A (0.38) PDE4APDE4BPDE4CPDE4DALDH1A1
SCHEMBL14009722 0.80 PDE4A (0.38) PDE4APDE4BPDE4CPDE4DALDH1A1
SCHEMBL14035841 0.80 PDE4A (0.44) PDE4APDE4BPDE4CPDE4DALDH1A1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20080287516-A1 Phenyl-Substituted Pyrrolidones IRM LLC (BM) 2008-11-20 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 (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-20080287516-A1 Phenyl-Substituted Pyrrolidones MALT1, FKBP5, PREP PDE4A 1181/4885PDE4B 1238/4885PDE4C 1261/4885

“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.