SCHEMBL537891

SCHEMBL537891

CCOc1cc(C(CC(=O)N(C)C)N2C(=O)c3cccc(NC(=O)CN(C)C)c3C2=O)ccc1OC

nearest known ligand 0.70

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
PDE4B Q07343 18/20 0.70
PDE4C Q08493 18/20 0.70
PDE4A P27815 12/20 0.70
PDE4D Q08499 12/20 0.70
HTR2B P41595 1/20 0.64
TNF P01375 2/20 0.53

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
SCHEMBL537231 1.00 PDE4B (0.70) PDE4BPDE4CPDE4APDE4DHTR2B
Hydrochloric Acid SCHEMBL537568 0.99 PDE4B (0.69) PDE4BPDE4CPDE4APDE4DHTR2B
SCHEMBL687861 0.99 PDE4B (0.69) PDE4BPDE4CPDE4APDE4DHTR2B
Hydrochloric Acid SCHEMBL537182 0.99 PDE4B (0.69) PDE4BPDE4CPDE4APDE4DHTR2B
Hydrochloric Acid SCHEMBL537567 0.98 PDE4B (0.68) PDE4BPDE4CPDE4APDE4DHTR2B
Hydrochloric Acid SCHEMBL537181 0.98 PDE4B (0.68) PDE4BPDE4CPDE4APDE4DHTR2B
SCHEMBL537499 0.94 PDE4B (0.73) PDE4BPDE4CPDE4APDE4DHTR2B
SCHEMBL537500 0.94 PDE4B (0.73) PDE4BPDE4CPDE4APDE4DHTR2B
SCHEMBL21494453 0.94 PDE4B (0.70) PDE4BPDE4CPDE4APDE4DHTR2B
Hydrochloric Acid SCHEMBL536503 0.94 PDE4B (0.72) 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 58 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1698334-B1 Pharmaceutically active isoindoline derivatives CELGENE CORP (US) 2011-04-20 EP claimed
EP-2555769-B1 METHODS FOR TREATING RESPIRATORY VIRAL INFECTION AMGEN EUROPE GMBH (CH) 2022-01-12 EP disclosed
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
US-RE45685-E1 Pharmaceutically active isoindoline derivatives CELGENE CORPORATION (US) 2015-09-29 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
WO-2005112917-A1 METHODS OF USING AND COMPOSITIONS COMPRISING SELECTIVE CYTOKINE INHIBITORY DRUGS FOR THE TREATMENT AND MANAGEMENT OF MYELOPROLIFERATIVE DISEASES CELGENE CORPORATION (US) 2005-12-01 WO disclosed
WO-2005110085-A2 USE OF SELECTIVE CYTOKINE INHIBITORY DRUGS IN MYELODYSPLASTIC SYNDROMES CELGENE CORPORATION (US) 2005-11-24 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
US-20040147588-A1 Pharmaceutically active isoindoline derivatives MAN HON-WAH 2004-07-29 US disclosed
US-6667316-B1 Amido or imido functionality; tumor necrosis factor alpha, phosphodiesterases, matrix metalloproteases and angiogenesis inhibitors CELGENE CORPORATION 2003-12-23 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 (7 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-20040147588-A1 Pharmaceutically active isoindoline derivatives PDE3A, PDE5A, PDE2A PDE4B 14/4885PDE4C 10/4885PDE4A 6/4885
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-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.