SCHEMBL3785757

SCHEMBL3785757

NC(=O)CCN1Cc2ccccc2C1=O

nearest known ligand 0.75

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 1/20 0.75
ALOX15 P16050 1/20 0.75
TSHR P16473 1/20 0.75
SIRT1 Q96EB6 1/20 0.75
HDAC1 Q13547 2/20 0.54
HDAC3 O15379 1/20 0.54
HDAC4 P56524 1/20 0.54
HDAC7 Q8WUI4 1/20 0.54
HDAC2 Q92769 1/20 0.54
HDAC10 Q969S8 1/20 0.54
HDAC11 Q96DB2 1/20 0.54
HDAC8 Q9BY41 1/20 0.54
HDAC6 Q9UBN7 1/20 0.54
HDAC9 Q9UKV0 1/20 0.54
HDAC5 Q9UQL6 1/20 0.54
SMN1; SMN2 Q16637 2/20 0.52
HTR1A P08908 1/20 0.49
DRD2 P14416 1/20 0.49
DRD5 P21918 1/20 0.49
DRD3 P35462 1/20 0.49

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
SCHEMBL7997184 0.92 KDM4E (0.68) KDM4EALOX15TSHRSIRT1HDAC1
SCHEMBL7995733 0.90 HDAC6 (0.67) KDM4EALOX15TSHRSIRT1HDAC1
SCHEMBL315339 0.86 KDM4E (1.00) KDM4EALOX15TSHRSIRT1HDAC1
SCHEMBL31188916 0.86 KDM4E (1.00) KDM4EALOX15TSHRSIRT1HDAC1
SCHEMBL6681752 0.85 KDM4E (0.55) KDM4EALOX15TSHRSIRT1DRD2
SCHEMBL15233568 0.84 KDM4E (0.75) KDM4EALOX15TSHRSIRT1HDAC1
SCHEMBL5034166 0.84 KDM4E (0.60) KDM4EALOX15TSHRSIRT1HDAC1
SCHEMBL29676812 0.84 KDM4E (0.60) KDM4EALOX15TSHRSIRT1HDAC1
SCHEMBL30073106 0.83 KDM4E (0.72) KDM4EALOX15TSHRSIRT1SMN1; SMN2
SCHEMBL30073110 0.83 KDM4E (0.72) KDM4EALOX15TSHRSIRT1SMN1; SMN2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20100331346-A1 BETA-AMINO ACID DERIVATIVES FOR TREATMENT OF DIABETES MERCK PATENT GESELLSCHAFT MIT BESCHRANKTER HAFTUNG (DE) 2010-12-30 US claimed
CN-1731997-A Methods of treating and controlling macular degeneration using compositions comprising selective cytokine inhibitory drugs CELGENE CORP (US) 2006-02-08 CN claimed
EP-2555769-B1 METHODS FOR TREATING RESPIRATORY VIRAL INFECTION AMGEN EUROPE GMBH (CH) 2022-01-12 EP disclosed
CN-102387798-A Methods of use of PDE4 modulators for the treatment, prevention and management of tuberculosis and compositions comprising the same CELGENE CORP 2012-03-21 CN disclosed
CN-1780616-B Selective cytokine inhibitory drugs for treating disorders of the central nervous system CELGENE CORP 2010-05-12 CN disclosed
CN-101309585-A Methods and compositions using pde4 modulators for treatment and management of central nervous system injury CELGENE CORP (US) 2008-11-19 CN disclosed
CN-101111235-A Methods of using and compositions comprising pde4 modulators for treatment, prevention and management airway inflammation CELGENE CORP (US) 2008-01-23 CN disclosed
CN-1984652-A Using methods and compositions comprising selective cytokine inhibitory drugs for treatment and management of myeloproliferative diseases CELGENE CORP (US) 2007-06-20 CN disclosed
CN-1984651-A Methods and compositions for treatment and management of cancer and other diseases using selective cytokine inhibitory drugs CELGENE CORP (US) 2007-06-20 CN disclosed
CN-1972684-A Methods of using and compositions comprising PDE4 modulators for the treatment and management of pulmonary hypertension CELGENE CORP (US) 2007-05-30 CN disclosed
CN-1972686-A Use of selective cytokine inhibitory drugs in myelodysplastic syndromes CELGENE CORP (US) 2007-05-30 CN disclosed
CN-1738614-A Compositions comprising (-) -3- (3, 4-dimethoxy-phenyl) -3- (1-oxo-1, 3-dihydro-isoindol-2-yl) -propionamide and methods of use thereof CELGENE CORP (US) 2006-02-22 CN disclosed
CN-1731997-A Methods of treating and controlling macular degeneration using compositions comprising selective cytokine inhibitory drugs CELGENE CORP (US) 2006-02-08 CN disclosed
CN-1731998-A Methods of using and compositions comprising selective cytokine inhibitory drugs for treatment, modification and management of pain CELGENE CORP (US) 2006-02-08 CN disclosed
CN-1713905-A Selective cytokine inhibitory drugs for treating myelodysplastic syndrome CELGENE CORP (US) 2005-12-28 CN disclosed
CN-1705439-A Modulation of stem and progenitor cell differentiation, assays, and uses thereof CELGENE CORP (US) 2005-12-07 CN disclosed
CN-1668296-A Methods and compositions using selective cytokine inhibitory drugs for treatment and management of cancers and other diseases CELGENE CORP (US) 2005-09-14 CN disclosed
EP-1567154-A2 METHODS AND COMPOSITIONS USING SELECTIVE CYTOKINE INHIBITORY DRUGS FOR TREATMENT AND MANAGEMENT OF CANCERS AND OTHER DISEASES CELGENE CORPORATION (US) 2005-08-31 EP disclosed
CN-1658848-A Methods for identification of modulators of angiogenesis, compounds discovered thereby, and methods of treatment using the compounds CELGENE CORP (US) 2005-08-24 CN disclosed
WO-2004043378-A2 METHODS AND COMPOSITIONS USING SELECTIVE CYTOKINE INHIBITORY DRUGS FOR TREATMENT AND MANAGEMENT OF CANCERS AND OTHER DISEASES CELGENE CORPORATION (US) 2004-05-27 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 (1 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-20100331346-A1 BETA-AMINO ACID DERIVATIVES FOR TREATMENT OF DIABETES GPR119, GLS, GCKR KDM4E 2872/4885ALOX15 3059/4885TSHR 1101/4885

“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.