SCHEMBL1827680

SCHEMBL1827680

CCOc1cc(C(CCN(OC(=O)OC(C)(C)C)C(=O)OC(C)(C)C)N2Cc3cccc(N)c3C2=O)ccc1OC

nearest known ligand 0.45

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
PDE4A P27815 15/20 0.45
PDE4B Q07343 15/20 0.45
PDE4C Q08493 15/20 0.45
PDE4D Q08499 15/20 0.45
TP53 P04637 1/20 0.41
TNF P01375 1/20 0.39
HTR2B P41595 1/20 0.39
MEN1 O00255 1/20 0.37
KMT2A Q03164 1/20 0.37

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
SCHEMBL1826919 1.00 PDE4A (0.45) PDE4APDE4BPDE4CPDE4DTP53
SCHEMBL8313746 0.89 TNF (0.42) PDE4APDE4BPDE4CPDE4DTP53
SCHEMBL1380546 0.86 PDE4B (0.43) PDE4APDE4BPDE4CPDE4DTP53
SCHEMBL1827682 0.86 PDE4A (0.42) PDE4APDE4BPDE4CPDE4DTP53
SCHEMBL1826921 0.86 PDE4A (0.42) PDE4APDE4BPDE4CPDE4DTP53
SCHEMBL15252405 0.84 PDE4B (0.53) PDE4APDE4BPDE4CPDE4DTP53
SCHEMBL1828170 0.84 UTS2R (0.50) PDE4APDE4BPDE4CPDE4DTP53
SCHEMBL3523624 0.84 PDE4A (0.47) PDE4APDE4BPDE4CPDE4DTP53
SCHEMBL1828169 0.84 PDE4A (0.47) PDE4APDE4BPDE4CPDE4DTP53
SCHEMBL1829132 0.84 PDE4A (0.54) PDE4APDE4BPDE4CPDE4DTP53

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
JP-4727571-B2 2011-07-20 JP claimed
EP-1606256-B1 N-ALKYL-HYDROXAMIC ACID-ISOINDOLYL COMPOUNDS AND THEIR PHARMACEUTICAL USES CELGENE CORP (US) 2011-05-04 EP claimed
US-20100267800-A1 N-Alkyl-Hydroxamic Acid-Isoindolyl Compounds and Their Pharmaceutical Uses CELGENE CORPORATION 2010-10-21 US claimed
US-8076369-B2 N-alkyl-hydroxamic acid-isoindolyl compounds and their pharmaceutical uses CELGENE CORPORATION (US) 2011-12-13 US disclosed
US-8076369-B2 N-alkyl-hydroxamic acid-isoindolyl compounds and their pharmaceutical uses CELGENE CORPORATION (US) 2011-12-13 US disclosed
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
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-20100267800-A1 N-Alkyl-Hydroxamic Acid-Isoindolyl Compounds and Their Pharmaceutical Uses CELGENE CORPORATION 2010-10-21 US 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
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-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-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
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 (2 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 PDE4A 1/4885PDE4B 2/4885PDE4C 5/4885
US-20100267800-A1 N-Alkyl-Hydroxamic Acid-Isoindolyl Compounds and Their Pharmaceutical Uses PDE4A, PDE12, PDE4B PDE4A 1/4885PDE4B 3/4885PDE4C 5/4885

“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.