SCHEMBL1826997

SCHEMBL1826997

CCOc1cc([C@@H](CCC(=O)N(CC(C)(C)OC(=O)O)OC(C)(C)C)N2Cc3cccc(NC(=O)C4CC4)c3C2=O)ccc1OC

nearest known ligand 0.39

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
PDE4B Q07343 15/20 0.39
PDE4C Q08493 15/20 0.39
PDE4A P27815 9/20 0.39
PDE4D Q08499 9/20 0.39
HTR2B P41595 1/20 0.39
TP53 P04637 1/20 0.38
TSHR P16473 1/20 0.35
MAPK1 P28482 1/20 0.35
NR1I2 O75469 1/20 0.34
UGCG Q16739 1/20 0.34
MEN1 O00255 1/20 0.34
KMT2A Q03164 1/20 0.34

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
SCHEMBL3619081 0.89 MAPT (0.37) TSHRNR1I2UGCGMEN1KMT2A
SCHEMBL1380543 0.87 PDE4B (0.42) PDE4BPDE4CPDE4APDE4DHTR2B
SCHEMBL1826996 0.87 PDE4B (0.42) PDE4BPDE4CPDE4APDE4DHTR2B
SCHEMBL3561288 0.87 PDE4B (0.41) PDE4BPDE4CPDE4APDE4DHTR2B
SCHEMBL1828096 0.85 TNF (0.40) PDE4BPDE4CPDE4APDE4DHTR2B
SCHEMBL1826872 0.85 TNF (0.40) PDE4BPDE4CPDE4APDE4DHTR2B
SCHEMBL6843737 0.84 PDE4B (0.45) PDE4BPDE4CPDE4APDE4DHTR2B
SCHEMBL3561283 0.83 PDE4B (0.42) PDE4BPDE4CPDE4APDE4DHTR2B
SCHEMBL3528755 0.83 PDE4B (0.43) PDE4BPDE4CPDE4APDE4DHTR2B
SCHEMBL1826949 0.83 PDE4B (0.48) 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 13 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1606256-B1 N-ALKYL-HYDROXAMIC ACID-ISOINDOLYL COMPOUNDS AND THEIR PHARMACEUTICAL USES CELGENE CORP (US) 2011-05-04 EP claimed
US-8076369-B2 N-alkyl-hydroxamic acid-isoindolyl compounds and their pharmaceutical uses CELGENE CORPORATION (US) 2011-12-13 US disclosed
EP-1606256-B1 N-ALKYL-HYDROXAMIC ACID-ISOINDOLYL COMPOUNDS AND THEIR PHARMACEUTICAL USES CELGENE CORP (US) 2011-05-04 EP disclosed
US-20100267800-A1 N-Alkyl-Hydroxamic Acid-Isoindolyl Compounds and Their Pharmaceutical Uses CELGENE CORPORATION 2010-10-21 US disclosed
US-7799819-B2 7-Amido-isoindolyl compounds and their pharmaceutical uses CELGENE CORPORATION (US) 2010-09-21 US disclosed
US-7662847-B2 Myelodysplastic syndrome, Parkinson*s disease, multiple sclerosis, AIDS, chronic obstructive pulmonary disease, acquired respiratory distress; analgesics, angiogenesis inhibitors; anticarcinogenic and antitumor agents; phopshodiesterase, tumor necrosis factor and matrix metalloproteinase inhibitors CELGENE CORPORATION (US) 2010-02-16 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-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-7034052-B2 7-Amido-isoindolyl compounds and their pharmaceutical uses CELGENE CORPORATION (US) 2006-04-25 US disclosed
US-20050203090-A1 Methods of using N-alkyl-hydroxamic acid-isoindolyl compounds AMGEN INC. 2005-09-15 US disclosed
US-6911464-B2 N-alkyl-hydroxamic acid-isoindolyl compounds and their pharmaceutical uses CELGENE CORPORATION (US) 2005-06-28 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 (4 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-20050203090-A1 Methods of using N-alkyl-hydroxamic acid-isoindolyl compounds PDE4A, PDE4B, PDE7A PDE4B 2/4885PDE4C 5/4885PDE4A 1/4885
US-20100267800-A1 N-Alkyl-Hydroxamic Acid-Isoindolyl Compounds and Their Pharmaceutical Uses PDE4A, PDE12, PDE4B PDE4B 3/4885PDE4C 5/4885PDE4A 1/4885
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.