SCHEMBL1823618

SCHEMBL1823618

CCOc1cc(C(CCCC(=O)NOC(C)=O)N2Cc3cccc(NC(=O)C4CC4)c3C2=O)ccc1OC

nearest known ligand 0.46

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
PDE4B Q07343 14/20 0.46
PDE4C Q08493 14/20 0.46
PDE4A P27815 8/20 0.46
PDE4D Q08499 8/20 0.46
HTR2B P41595 1/20 0.43
TP53 P04637 1/20 0.42
MEN1 O00255 1/20 0.39
KMT2A Q03164 1/20 0.39
TSHR P16473 1/20 0.39
MAPK1 P28482 1/20 0.39

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
SCHEMBL13165899 0.92 PDE4A (0.50) PDE4BPDE4CPDE4APDE4DHTR2B
SCHEMBL5513420 0.92 PDE4A (0.50) PDE4BPDE4CPDE4APDE4DHTR2B
SCHEMBL1825058 0.89 PDE4B (0.43) PDE4BPDE4CPDE4APDE4DHTR2B
SCHEMBL13165893 0.88 PDE4B (0.49) PDE4BPDE4CPDE4APDE4DHTR2B
SCHEMBL5515932 0.88 PDE4B (0.49) PDE4BPDE4CPDE4APDE4DHTR2B
SCHEMBL5509182 0.87 PDE4B (0.48) PDE4BPDE4CPDE4APDE4DHTR2B
SCHEMBL1826949 0.87 PDE4B (0.48) PDE4BPDE4CPDE4APDE4DHTR2B
SCHEMBL6843737 0.87 PDE4B (0.45) PDE4BPDE4CPDE4APDE4DHTR2B
SCHEMBL5511996 0.87 PDE4B (0.51) PDE4BPDE4CPDE4APDE4DHTR2B
SCHEMBL13002994 0.87 PDE4B (0.51) 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
US-8076369-B2 N-alkyl-hydroxamic acid-isoindolyl compounds and their pharmaceutical uses CELGENE CORPORATION (US) 2011-12-13 US claimed
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 claimed
US-6911464-B2 N-alkyl-hydroxamic acid-isoindolyl compounds and their pharmaceutical uses CELGENE CORPORATION (US) 2005-06-28 US claimed
US-20040259873-A1 N-alkyl-hydroxamic acid-isoindolyl compounds and their pharmaceutical uses AMGEN INC. 2004-12-23 US 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-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
EP-1606256-A2 N-ALKYL-HYDROXAMIC ACID-ISOINDOLYL COMPOUNDS AND THEIR PHARMACEUTICAL USES CELGENE CORPORATION (US) 2005-12-21 EP 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
US-20040259873-A1 N-alkyl-hydroxamic acid-isoindolyl compounds and their pharmaceutical uses AMGEN INC. 2004-12-23 US disclosed
WO-2004080422-A2 N-ALKYL-HYDROXAMIC ACID-ISOINDOLYL COMPOUNDS AND 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-20040259873-A1 N-alkyl-hydroxamic acid-isoindolyl compounds and their pharmaceutical uses PDE4A, PDE12, PDE4B PDE4B 3/4885PDE4C 5/4885PDE4A 1/4885
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

“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.