SCHEMBL3767503

SCHEMBL3767503

CCOc1cc([C@@H](CS(C)(=O)=O)N2C(=O)c3cccc(NC(=O)CN(C)C)c3C2=O)ccc1OC

nearest known ligand 0.81

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
PDE4B Q07343 20/20 0.81
PDE4C Q08493 19/20 0.81
PDE4A P27815 13/20 0.81
PDE4D Q08499 13/20 0.81
HTR2B P41595 1/20 0.81

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
SCHEMBL845079 1.00 PDE4B (0.81) PDE4BPDE4CPDE4APDE4DHTR2B
SCHEMBL540336 1.00 PDE4B (0.81) PDE4BPDE4CPDE4APDE4DHTR2B
Hydrochloric Acid SCHEMBL537210 0.99 PDE4B (0.80) PDE4BPDE4CPDE4APDE4DHTR2B
Hydrochloric Acid SCHEMBL537316 0.99 PDE4B (0.80) PDE4BPDE4CPDE4APDE4DHTR2B
Hydrochloric Acid SCHEMBL537053 0.99 PDE4B (0.80) PDE4BPDE4CPDE4APDE4DHTR2B
Hydrochloric Acid SCHEMBL1582972 0.98 PDE4B (0.79) PDE4BPDE4CPDE4APDE4DHTR2B
Hydrochloric Acid SCHEMBL537209 0.98 PDE4B (0.79) PDE4BPDE4CPDE4APDE4DHTR2B
Hydrochloric Acid SCHEMBL537315 0.98 PDE4B (0.79) PDE4BPDE4CPDE4APDE4DHTR2B
SCHEMBL1582625 0.94 PDE4B (0.71) PDE4BPDE4CPDE4APDE4DHTR2B
Hydrochloric Acid SCHEMBL537237 0.94 PDE4B (0.70) 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 33 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-10682336-B2 PDE4 modulators for treating and preventing immune reconstitution inflammatory syndrome (IRIS) AMGEN INC. (US) 2020-06-16 US disclosed
US-20180318257-A1 PDE4 MODULATORS FOR TREATING AND PREVENTING IMMUNE RECONSTITUTION INFLAMMATORY SYNDROME (IRIS) CELGENE CORPORATION 2018-11-08 US disclosed
EP-2583098-B1 BIOMARKERS FOR THE TREATMENT OF PSORIASIS CELGENE CORP (US) 2018-08-08 EP disclosed
US-20170087129-A1 COMPOSITIONS AND METHODS FOR THE TREATMENT OF ATHEROSCLEROTIC CARDIOVASCULAR DISEASES WITH PDE4 MODULATORS NEW YORK UNIVERSITY 2017-03-30 US disclosed
US-20160289188-A1 COMPOSITIONS AND METHODS FOR THE TREATMENT OF VIRAL DISEASES WITH PDE4 MODULATORS CELGENE CORPORATION 2016-10-06 US disclosed
US-9408831-B2 Methods for treating respiratory viral infection CELGENE CORPORATION (US) 2016-08-09 US disclosed
EP-2818164-A1 Methods of using and compositions comprising PDE4-modulators for treatment, prevention and management of tuberculosis CELGENE CORPORATION (US) 2014-12-31 EP disclosed
US-20130136770-A1 METHODS FOR TREATING RESPIRATORY VIRAL INFECTION CELGENE CORPORATION (US) 2013-05-30 US disclosed
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
US-20110318741-A1 BIOMARKERS FOR THE TREATMENT OF PSORIASIS AMGEN INC. 2011-12-29 US disclosed
EP-1684756-A1 CYTOKINE INHIBITORY DRUGS FOR TREATMENT OF MACULAR DEGENERATION CELGENE CORPORATION (US) 2006-08-02 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
WO-2006065814-A1 COMPOSITIONS COMPRISING PDE4 MODULATORS AND THEIR USE FOR THE TREATMENT OR PREVENTION OF AIRWAY INFLAMMATION CELGENE CORPORATION (US) 2006-06-22 WO disclosed
US-20060106085-A1 Methods and compositions using PDE4 modulators for treatment and management of central nervous system injury CELGENE CORPORATION 2006-05-18 US disclosed
WO-2006050057-A2 METHODS AND COMPOSITIONS USING PDE4 MODULATORS FOR TREATMENT AND MANAGEMENT OF CENTRAL NERVOUS SYSTEM INJURY CELGENE CORPORATION (US) 2006-05-11 WO disclosed
WO-2005102317-A1 METHODS OF USING AND COMPOSITIONS COMPRISING PDE4 MODULATORS FOR THE TREATMENT AND MANAGEMENT OF PULMONARY HYPERTENSION CELGENE CORPORATION (US) 2005-11-03 WO disclosed
US-20050239867-A1 Methods of using and compositions comprising PDE4 modulators for the treatment and management of pulmonary hypertension CELGENE CORPORATION 2005-10-27 US disclosed
US-20050142104-A1 Methods of using and compositions comprising PDE4 modulators for the treatment and management of asbestos-related diseases and disorders CELGENE CORPORATION 2005-06-30 US disclosed
WO-2005046592-A2 METHODS OF USING AND COMPOSITIONS COMPRISING PDE4 MODULATORS FOR THE TREATMENT AND MANAGEMENT OF ASBESTOS-RELATED DISEASES AND DISORDERS CELGENE CORPORATION (US) 2005-05-26 WO disclosed
WO-2005044269-A1 CYTOKINE INHIBITORY DRUGS FOR TREATMENT OF MACULAR DEGENERATION CELGENE CORPORATION (US) 2005-05-19 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 (10 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-20050142104-A1 Methods of using and compositions comprising PDE4 modulators for the treatment and management of asbestos-related diseases and disorders PDE4A, PDE12, PDE4B PDE4B 3/4885PDE4C 8/4885PDE4A 1/4885
US-20050239867-A1 Methods of using and compositions comprising PDE4 modulators for the treatment and management of pulmonary hypertension PDE4A, PDE12, PDE4B PDE4B 3/4885PDE4C 8/4885PDE4A 1/4885
US-20130136770-A1 METHODS FOR TREATING RESPIRATORY VIRAL INFECTION PDE4A, PDE4B, IL4 PDE4B 2/4885PDE4C 4/4885PDE4A 1/4885
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
US-20160289188-A1 COMPOSITIONS AND METHODS FOR THE TREATMENT OF VIRAL DISEASES WITH PDE4 MODULATORS PDE4A, PDE4B, PDE4C PDE4B 2/4885PDE4C 3/4885PDE4A 1/4885
US-20170087129-A1 COMPOSITIONS AND METHODS FOR THE TREATMENT OF ATHEROSCLEROTIC CARDIOVASCULAR DISEASES WITH PDE4 MODULATORS PDE4A, PDE4B, PDE3B PDE4B 2/4885PDE4C 4/4885PDE4A 1/4885
US-20060106085-A1 Methods and compositions using PDE4 modulators for treatment and management of central nervous system injury PDE4A, PDE4B, PDE4C PDE4B 2/4885PDE4C 3/4885PDE4A 1/4885
US-20180318257-A1 PDE4 MODULATORS FOR TREATING AND PREVENTING IMMUNE RECONSTITUTION INFLAMMATORY SYNDROME (IRIS) PDE4A, PDE4B, PDE3A PDE4B 2/4885PDE4C 5/4885PDE4A 1/4885
US-10682336-B2 PDE4 modulators for treating and preventing immune reconstitution inflammatory syndrome (IRIS) PDE4A, PDE4B, PDE3A PDE4B 2/4885PDE4C 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.