SCHEMBL17848801

SCHEMBL17848801

CCOc1cc([C@@H](CS(C)(=O)=O)N2C(=O)c3cccc(CC(N)=O)c3C2=O)ccc1OC

nearest known ligand 0.79

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
PDE4B Q07343 20/20 0.79
PDE4C Q08493 19/20 0.79
PDE4A P27815 13/20 0.79
PDE4D Q08499 13/20 0.79
HTR2B P41595 1/20 0.72

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
SCHEMBL22029271 1.00 PDE4B (0.79) PDE4BPDE4CPDE4APDE4DHTR2B
Alcohol SCHEMBL17848800 0.98 PDE4B (0.77) PDE4BPDE4CPDE4APDE4DHTR2B
Acetone SCHEMBL17848799 0.98 PDE4B (0.76) PDE4BPDE4CPDE4APDE4DHTR2B
SCHEMBL17848804 0.97 PDE4B (0.75) PDE4BPDE4CPDE4APDE4DHTR2B
Propanol SCHEMBL17848792 0.97 PDE4B (0.74) PDE4BPDE4CPDE4APDE4DHTR2B
Isobutyraldehyde SCHEMBL17848805 0.95 PDE4B (0.72) PDE4BPDE4CPDE4APDE4DHTR2B
SCHEMBL28672780 0.93 PDE4B (0.77) PDE4BPDE4CPDE4APDE4DHTR2B
SCHEMBL30626414 0.93 PDE4B (0.77) PDE4BPDE4CPDE4APDE4DHTR2B
SCHEMBL7401395 0.92 PDE4B (0.76) PDE4BPDE4CPDE4APDE4DHTR2B
SCHEMBL537193 0.90 PDE4B (0.83) PDE4BPDE4CPDE4APDE4DHTR2B

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
US-20200181085-A1 NOVEL PROCESS TO PREPARE N-[2-[(1S)-1-(3-ETHOXY-4-METHOXYPHENYL)-2-(METHYLSULPHONYL) ETHYL]-1, 3-DIOXO-2,3-DIHYDRO-1H-ISOINDOL-4-YL]ACETAMIDE UNICHEM LABORATORIES LTD (IN) 2020-06-11 US disclosed
EP-3390360-A1 PROCESS FOR THE PREPARATION OF A PHARMACEUTICAL AGENT Zaklady Farmaceutyczne Polpharma SA (PL) 2018-10-24 EP disclosed
WO-2017105263-A1 PROCESS FOR THE PREPARATION OF A PHARMACEUTICAL AGENT ZAKLADY FARMACEUTYCZNE POLPHARMA SA (PL) 2017-06-22 WO disclosed
WO-2016097156-A1 NOVEL SOLVATES OF N-[2-[(1S)-1-(3-ETHOXY-4-METHOXYPHENYL)-2-(METHYLSULFONYL)ETHYL]-2,3-DIHYDRO-1,3-DIOXO-1H-ISOINDOL-4-YL]ACETAMIDE LEK PHARMACEUTICALS D.D. (SI) 2016-06-23 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-20200181085-A1 NOVEL PROCESS TO PREPARE N-[2-[(1S)-1-(3-ETHOXY-4-METHOXYPHENYL)-2-(METHYLSULPHONYL) ETHYL]-1, 3-DIOXO-2,3-DIHYDRO-1H-ISOINDOL-4-YL]ACETAMIDE BCKDK, DMPK, MYLK PDE4B 975/4885PDE4C 1664/4885PDE4A 1213/4885

“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.