SCHEMBL537220

SCHEMBL537220

CCOc1cc([C@@H](CC(=O)N(C)C)N2Cc3cccc(NC(=O)CCl)c3C2=O)ccc1OC

nearest known ligand 0.50

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
TP53 P04637 2/20 0.50
PDE4B Q07343 11/20 0.49
PDE4C Q08493 11/20 0.49
PDE4A P27815 9/20 0.49
PDE4D Q08499 9/20 0.49
HTR2B P41595 1/20 0.46
MEN1 O00255 1/20 0.46
KMT2A Q03164 1/20 0.46
MAPT P10636 2/20 0.45

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
SCHEMBL1582796 1.00 TP53 (0.50) TP53PDE4BPDE4CPDE4APDE4D
SCHEMBL694925 0.91 PDE4B (0.59) TP53PDE4BPDE4CPDE4APDE4D
SCHEMBL2465157 0.91 PDE4B (0.51) TP53PDE4BPDE4CPDE4APDE4D
SCHEMBL537211 0.91 PDE4B (0.59) TP53PDE4BPDE4CPDE4APDE4D
SCHEMBL8288776 0.91 PDE4B (0.51) TP53PDE4BPDE4CPDE4APDE4D
SCHEMBL8279948 0.90 PDE4B (0.50) TP53PDE4BPDE4CPDE4APDE4D
SCHEMBL694628 0.88 PDE4B (0.49) TP53PDE4BPDE4CPDE4APDE4D
SCHEMBL537241 0.88 PDE4B (0.49) TP53PDE4BPDE4CPDE4APDE4D
SCHEMBL8279946 0.87 TP53 (0.47) TP53PDE4BPDE4CPDE4APDE4D
SCHEMBL2462782 0.87 TP53 (0.47) TP53PDE4BPDE4CPDE4APDE4D

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1698334-A1 Pharmaceutically active isoindoline derivatives CELGENE CORPORATION (US) 2006-09-06 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
WO-2017070291-A1 PDE4 MODULATORS FOR TREATING AND PREVENTING IMMUNE RECONSTITUTION INFLAMMATORY SYNDROME (IRIS) CELGENE CORPORATION (US) 2017-04-27 WO 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
EP-3142663-A1 COMPOSITIONS AND METHODS FOR THE TREATMENT OF ATHEROSCLEROTIC CARDIOVASCULAR DISEASES WITH PDE4 MODULATORS Celgene Corporation (US) 2017-03-22 EP disclosed
US-20160289188-A1 COMPOSITIONS AND METHODS FOR THE TREATMENT OF VIRAL DISEASES WITH PDE4 MODULATORS CELGENE CORPORATION 2016-10-06 US disclosed
EP-3065778-A1 COMPOSITIONS AND METHODS FOR THE TREATMENT OF VIRAL DISEASES WITH PDE4 MODULATORS Celgene Corporation (US) 2016-09-14 EP disclosed
WO-2005094218-A2 METHODS OF USING AND COMPOSITIONS COMPRISING SELECTIVE CYTOKINE INHIBITORY DRUGS FOR THE TREATMENT AND MANAGEMENT OF DISORDERS OF THE CENTRAL NERVOUS SYSTEM CELGENE CORPORATION (US) 2005-10-13 WO 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-2005043971-A2 METHODS OF USING AND COMPOSITIONS COMPRISING SELECTIVE CYTOKINE INHIBITORY DRUGS FOR TREATMENT, MODIFICATION AND MANAGEMENT OF PAIN CELGENE CORPORATION (US) 2005-05-19 WO disclosed
WO-2005044269-A1 CYTOKINE INHIBITORY DRUGS FOR TREATMENT OF MACULAR DEGENERATION CELGENE CORPORATION (US) 2005-05-19 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 (6 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 TP53 244/4885PDE4B 3/4885PDE4C 8/4885
US-20040147588-A1 Pharmaceutically active isoindoline derivatives PDE3A, PDE5A, PDE2A TP53 2383/4885PDE4B 14/4885PDE4C 10/4885
US-20160289188-A1 COMPOSITIONS AND METHODS FOR THE TREATMENT OF VIRAL DISEASES WITH PDE4 MODULATORS PDE4A, PDE4B, PDE4C TP53 3904/4885PDE4B 2/4885PDE4C 3/4885
US-20170087129-A1 COMPOSITIONS AND METHODS FOR THE TREATMENT OF ATHEROSCLEROTIC CARDIOVASCULAR DISEASES WITH PDE4 MODULATORS PDE4A, PDE4B, PDE3B TP53 4785/4885PDE4B 2/4885PDE4C 4/4885
US-20180318257-A1 PDE4 MODULATORS FOR TREATING AND PREVENTING IMMUNE RECONSTITUTION INFLAMMATORY SYNDROME (IRIS) PDE4A, PDE4B, PDE3A TP53 4224/4885PDE4B 2/4885PDE4C 5/4885
US-10682336-B2 PDE4 modulators for treating and preventing immune reconstitution inflammatory syndrome (IRIS) PDE4A, PDE4B, PDE3A TP53 4224/4885PDE4B 2/4885PDE4C 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.