SCHEMBL1193446

SCHEMBL1193446

COc1ccc(C(CS(C)(=O)=O)N2C(=O)c3ccccc3C2=O)cc1OC1CCCC1

nearest known ligand 1.00 ✓ in ChEMBL — recovers established targets

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
PDE4A P27815 18/20 1.00
PDE4B Q07343 18/20 1.00
PDE4C Q08493 18/20 1.00
PDE4D Q08499 18/20 1.00
TNF P01375 4/20 0.53
HTR2B P41595 1/20 0.51

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
SCHEMBL9977548 1.00 PDE4A (1.00) PDE4APDE4BPDE4CPDE4DTNF
SCHEMBL4637197 0.89 PDE4A (0.79) PDE4APDE4BPDE4CPDE4DTNF
SCHEMBL1193568 0.88 PDE4B (0.77) PDE4APDE4BPDE4CPDE4DHTR2B
SCHEMBL9977546 0.87 PDE4A (0.80) PDE4APDE4BPDE4CPDE4DTNF
SCHEMBL23509448 0.86 PDE4B (0.75) PDE4APDE4BPDE4CPDE4DHTR2B
SCHEMBL7440313 0.85 PDE4A (0.77) PDE4APDE4BPDE4CPDE4DTNF
SCHEMBL7432884 0.85 PDE4A (0.74) PDE4APDE4BPDE4CPDE4DTNF
Cdc-801 SCHEMBL185853 0.84 PDE4A (1.00) PDE4APDE4BPDE4CPDE4DTNF
SCHEMBL4637167 0.84 PDE4A (1.00) PDE4APDE4BPDE4CPDE4DTNF
SCHEMBL9977581 0.84 PDE4A (1.00) PDE4APDE4BPDE4CPDE4DTNF

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 45 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-6020358-A REDUCING TUMOR NECROSIS FACTOR CONCENTRATION CELGENE CORPORATION (US) 2000-02-01 US claimed
US-8263637-B2 Methods for treatment of multiple myeloma using cyclopropane carboxylic acid {2-[(is)-1-(3-ethoxy-4-methoxy-phenyl)-2-methanesulfonyl-ethyl]-3-oxo-2,3-dihydro-1 h-isoindol-4-yl}-amide CELGENE CORPORATION (US) 2012-09-11 US disclosed
US-20120165292-A2 METHODS FOR TREATMENT OF MULTIPLE MYELOMA USING CYCLOPROPANE CARBOXYLIC ACID {2-(Is)-(3-eTHOXY-4METHOXY-PHENYL)-2-METHANESULFONYL-ETHYL}-3-OXO-2.3-DIHYDRO-1H-ISOINDOL-4-YL}-AMIDE CELGENE CORPORATION (US) 2012-06-28 US disclosed
WO-2012083153-A1 OLIGOMER-CONTAINING APREMILAST MOIETY COMPOUNDS NEKTAR THERAPEUTICS (US) 2012-06-21 WO disclosed
US-20110038832-A1 METHOD FOR TREATMENT OF MACULAR DEGENERATION USING (+)-2-[1-(3-ETHOXY-4-METHOXYPHENYL)-2-METHYLSULFONYLETHYL]-4-ACETYLAMINOISOINDOLINE-1,3-DIONE CELGENE CORPORATION 2011-02-17 US disclosed
EP-2258363-A1 Compositions for treatment of cancers CELGENE CORPORATION (US) 2010-12-08 EP disclosed
US-7842691-B2 Method for the treatment of myelodysplastic syndromes using cyclopropanecarboxylic acid {2-[1-(3-ethoxy-4-methoxy-phenyl)-2-methanesulfonyl-ethyl]-3-OXO-2,3-dihydro-1 H-isoindol-4-yl}-amide CELGENE CORPORATION (US) 2010-11-30 US disclosed
US-7776907-B2 Methods for the treatment and management of macular degeneration using cyclopropyl-N-{2-[(1S)-1-(3-ethoxy-4-methoxyphenyl)-2-(methylsulfonyl)ethyl]-3-oxoisoindoline-4-yl}carboxamide CELGENE CORPORATION (US) 2010-08-17 US disclosed
EP-1587474-B1 FLUOROALKOXY-SUBSTITUTED 1, 3-DIHYDRO-ISOINDOLYL COMPOUNDS AND THEIR PHARMACEUTICAL USES CELGENE CORP (US) 2009-11-18 EP disclosed
EP-1569903-A4 METHODS OF USING AND COMPOSITIONS COMPRISING SELECTIVE CYTOKINE INHIBITORY DRUGS FOR THE TREATMENT AND MANAGEMENT OF MYELOPROLIFERATIVE DISEASES CELGENE CORP (US) 2009-07-29 EP disclosed
WO-2004034962-A2 SELECTIVE CYTOKINE INHIBITORY DRUGS FOR TREATING MYELODYSPLASTIC SYNDROME CELGENE CORPORATION (US) 2004-04-29 WO disclosed
WO-2003097040-A1 METHODS AND COMPOSITIONS USING SELECTIVE CYTOKINE INHIBITORY DRUGS FOR TREATMENT AND MANAGEMENT OF CANCERS AND OTHER DISEASES CELGENE CORPORATION (US) 2003-11-27 WO disclosed
WO-2003086373-A1 METHODS FOR IDENTIFICATION OF MODULATORS OF ANGIOGENESIS, COMPOUNDS DISCOVERED THEREBY, AND METHODS OF TREATMENT USING THE COMPOUNDS CELGENE CORPORATION (US) 2003-10-23 WO disclosed
EP-1242082-A1 METHODS AND COMPOSITIONS FOR THE PREVENTION AND TREATMENT OF ATHEROSCLEROSIS, RESTENOSIS AND RELATED DISORDERS CELGENE CORPORATION (US) 2002-09-25 EP disclosed
US-20020054899-A1 Methods and compositions for the prevention and treatment of atherosclerosis, restenosis and related disorders CELGENE CORP. 2002-05-09 US disclosed
WO-2001043743-A1 METHODS AND COMPOSITIONS FOR THE PREVENTION AND TREATMENT OF ATHEROSCLEROSIS, RESTENOSIS AND RELATED DISORDERS CELGENE CORP. (US) 2001-06-21 WO disclosed
US-6020358-A REDUCING TUMOR NECROSIS FACTOR CONCENTRATION CELGENE CORPORATION (US) 2000-02-01 US disclosed
US-6020358-A REDUCING TUMOR NECROSIS FACTOR CONCENTRATION CELGENE CORPORATION (US) 2000-02-01 US disclosed
US-6011050-A Substituted phenethylsulfones and method of reducing TNFα levels CELGENE CORPORATION (US) 2000-01-04 US disclosed
US-6011050-A Substituted phenethylsulfones and method of reducing TNFα levels CELGENE CORPORATION (US) 2000-01-04 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 (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-20120165292-A2 METHODS FOR TREATMENT OF MULTIPLE MYELOMA USING CYCLOPROPANE CARBOXYLIC ACID {2-(Is)-(3-eTHOXY-4METHOXY-PHENYL)-2-METHANESULFONYL-ETHYL}-3-OXO-2.3-DIHYDRO-1H-ISOINDOL-4-YL}-AMIDE IL2, HDGF, VEGFA PDE4A 1843/4885PDE4B 1724/4885PDE4C 1641/4885
US-20110038832-A1 METHOD FOR TREATMENT OF MACULAR DEGENERATION USING (+)-2-[1-(3-ETHOXY-4-METHOXYPHENYL)-2-METHYLSULFONYLETHYL]-4-ACETYLAMINOISOINDOLINE-1,3-DIONE ALDH1A2, MTNR1A, MTNR1B PDE4A 243/4885PDE4B 438/4885PDE4C 452/4885

“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.