SCHEMBL540337

SCHEMBL540337

CCOc1cc(C(CS(C)(=O)=O)N2C(=O)c3cccc(N(C(C)=O)N(C)C)c3C2=O)ccc1OC

nearest known ligand 0.82

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
PDE4B Q07343 20/20 0.82
PDE4C Q08493 19/20 0.82
PDE4A P27815 13/20 0.82
PDE4D Q08499 13/20 0.82
HTR2B P41595 1/20 0.72

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
Hydrochloric Acid SCHEMBL537170 0.99 PDE4B (0.81) PDE4BPDE4CPDE4APDE4DHTR2B
SCHEMBL26546185 0.93 PDE4B (0.82) PDE4BPDE4CPDE4APDE4DHTR2B
Propane SCHEMBL17835994 0.91 PDE4B (0.79) PDE4BPDE4CPDE4APDE4DHTR2B
SCHEMBL9977587 0.91 PDE4B (1.00) PDE4BPDE4CPDE4APDE4DHTR2B
SCHEMBL1195086 0.91 PDE4B (1.00) PDE4BPDE4CPDE4APDE4DHTR2B
SCHEMBL537489 0.88 PDE4B (0.85) PDE4BPDE4CPDE4APDE4DHTR2B
SCHEMBL9977589 0.86 PDE4B (1.00) PDE4BPDE4CPDE4APDE4DHTR2B
SCHEMBL1194004 0.86 PDE4B (1.00) PDE4BPDE4CPDE4APDE4DHTR2B
SCHEMBL9977553 0.85 PDE4B (1.00) PDE4BPDE4CPDE4APDE4DHTR2B
SCHEMBL9977579 0.85 PDE4B (1.00) 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 11 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20120149716-A1 METHODS OF USING AND COMPOSITIONS COMPRISING PDE4 MODULATORS FOR TREATMENT, PREVENTION AND MANAGEMENT OF TUBERCULOSIS CELGENE CORPORATION 2012-06-14 US disclosed
EP-1228071-B8 PHARMACEUTICALLY ACTIVE ISOINDOLINE DERIVATIVES CELGENE CORP (US) 2012-02-29 EP disclosed
EP-2263669-B1 Pharmaceutically active isoindoline derivatives CELGENE CORP (US) 2012-02-08 EP disclosed
US-20110318741-A1 BIOMARKERS FOR THE TREATMENT OF PSORIASIS AMGEN INC. 2011-12-29 US disclosed
WO-2011159750-A1 BIOMARKERS FOR THE TREATMENT OF PSORIASIS CELGENE CORPORATION (US) 2011-12-22 WO disclosed
WO-2011127019-A2 METHODS FOR TREATING RESPIRATORY VIRAL INFECTION CELGENE CORPORATION (US) 2011-10-13 WO disclosed
EP-1228071-B1 PHARMACEUTICALLY ACTIVE ISOINDOLINE DERIVATIVES CELGENE CORP (US) 2007-03-28 EP disclosed
US-20060148882-A1 Methods of using and compositions comprising PDE4 modulators for treatment, prevention and management airway inflammation ZELDIS JEROME B 2006-07-06 US disclosed
EP-1228071-A4 PHARMACEUTICALLY ACTIVE ISOINDOLINE DERIVATIVES CELGENE CORP (US) 2002-12-04 EP disclosed
EP-1228071-A1 PHARMACEUTICALLY ACTIVE ISOINDOLINE DERIVATIVES CELGENE CORPORATION (US) 2002-08-07 EP disclosed
WO-2001034606-A1 PHARMACEUTICALLY ACTIVE ISOINDOLINE DERIVATIVES CELGENE CORPORATION (US) 2001-05-17 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-20120149716-A1 METHODS OF USING AND COMPOSITIONS COMPRISING PDE4 MODULATORS FOR TREATMENT, PREVENTION AND MANAGEMENT OF TUBERCULOSIS PDE4A, PDE4B, PDE4C PDE4B 2/4885PDE4C 3/4885PDE4A 1/4885
US-20060148882-A1 Methods of using and compositions comprising PDE4 modulators for treatment, prevention and management airway inflammation PDE4A, PDE4B, PDE12 PDE4B 2/4885PDE4C 6/4885PDE4A 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.