SCHEMBL3558205

SCHEMBL3558205

CCOc1cc(C(CS(C)(=O)=O)N2Cc3cccc(NC(=O)C(C)C)c3C2=O)ccc1OC

nearest known ligand 0.60

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
PDE4B Q07343 20/20 0.60
PDE4C Q08493 18/20 0.60
PDE4A P27815 12/20 0.60
PDE4D Q08499 12/20 0.60
HTR2B P41595 1/20 0.60

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
SCHEMBL21761704 0.92 PDE4B (0.71) PDE4BPDE4CPDE4APDE4DHTR2B
SCHEMBL1551525 0.90 PDE4B (0.60) PDE4BPDE4CPDE4APDE4DHTR2B
SCHEMBL1551526 0.90 PDE4B (0.60) PDE4BPDE4CPDE4APDE4DHTR2B
SCHEMBL2466089 0.90 PDE4B (0.60) PDE4BPDE4CPDE4APDE4DHTR2B
SCHEMBL2466090 0.90 PDE4B (0.60) PDE4BPDE4CPDE4APDE4DHTR2B
Dovramilast SCHEMBL14983202 0.89 PDE4B (0.59) PDE4BPDE4CPDE4APDE4DHTR2B
Dovramilast SCHEMBL15869364 0.89 PDE4B (0.59) PDE4BPDE4CPDE4APDE4DHTR2B
Dovramilast SCHEMBL29366888 0.89 PDE4B (0.59) PDE4BPDE4CPDE4APDE4DHTR2B
Dovramilast SCHEMBL673303 0.89 PDE4B (0.59) PDE4BPDE4CPDE4APDE4DHTR2B
Dovramilast SCHEMBL30701938 0.89 PDE4B (0.59) 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 18 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7799819-B2 7-Amido-isoindolyl compounds and their pharmaceutical uses CELGENE CORPORATION (US) 2010-09-21 US disclosed
US-7799819-B2 7-Amido-isoindolyl compounds and their pharmaceutical uses CELGENE CORPORATION (US) 2010-09-21 US disclosed
US-7799819-B2 7-Amido-isoindolyl compounds and their pharmaceutical uses CELGENE CORPORATION (US) 2010-09-21 US disclosed
US-20090131505-A1 7-Amido-isoindolyl Compounds and Their Pharmaceutical Uses MAN HON-WAH 2009-05-21 US disclosed
US-20090131505-A1 7-Amido-isoindolyl Compounds and Their Pharmaceutical Uses MAN HON-WAH 2009-05-21 US disclosed
US-20090131505-A1 7-Amido-isoindolyl Compounds and Their Pharmaceutical Uses MAN HON-WAH 2009-05-21 US disclosed
US-7511072-B2 7-amido-isoindolyl compounds and methods of its use CELGENE CORPORATION (US) 2009-03-31 US disclosed
US-7511072-B2 7-amido-isoindolyl compounds and methods of its use CELGENE CORPORATION (US) 2009-03-31 US disclosed
US-7511072-B2 7-amido-isoindolyl compounds and methods of its use CELGENE CORPORATION (US) 2009-03-31 US disclosed
US-20070254942-A1 7-amido-isoindolyl compounds and methods of its use CELGENE CORPORATION. 2007-11-01 US disclosed
US-20070254942-A1 7-amido-isoindolyl compounds and methods of its use CELGENE CORPORATION. 2007-11-01 US disclosed
US-20070254942-A1 7-amido-isoindolyl compounds and methods of its use CELGENE CORPORATION. 2007-11-01 US disclosed
US-7256210-B2 7-amido-isoindolyl compounds and methods of their use CELGENE CORPORATION (US) 2007-08-14 US disclosed
US-7256210-B2 7-amido-isoindolyl compounds and methods of their use CELGENE CORPORATION (US) 2007-08-14 US disclosed
US-7256210-B2 7-amido-isoindolyl compounds and methods of their use CELGENE CORPORATION (US) 2007-08-14 US disclosed
US-7034052-B2 7-Amido-isoindolyl compounds and their pharmaceutical uses CELGENE CORPORATION (US) 2006-04-25 US disclosed
US-20060058362-A1 7-Amido-isoindolyl compounds and methods of their use MAN HON-WAH 2006-03-16 US disclosed
WO-2004080423-A2 7-AMINO- ISOINDOLYL COMPOUNDS AMD THEIR PHARMACEUTICAL USES CELGENE CORPORATION (US) 2004-09-23 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 (3 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-20060058362-A1 7-Amido-isoindolyl compounds and methods of their use MCL1, APC, HPGDS PDE4B 2106/4885PDE4C 1281/4885PDE4A 1516/4885
US-20090131505-A1 7-Amido-isoindolyl Compounds and Their Pharmaceutical Uses THPO, MCL1, HPGDS PDE4B 564/4885PDE4C 874/4885PDE4A 576/4885
US-20070254942-A1 7-amido-isoindolyl compounds and methods of its use MCL1, THPO, APC PDE4B 1964/4885PDE4C 2369/4885PDE4A 2086/4885

“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.