SCHEMBL4381249

SCHEMBL4381249

CCC(=O)SC(=O)CN1C(=O)CCC1=O

nearest known ligand 0.39

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
TSHR P16473 2/20 0.38
SMN1; SMN2 Q16637 3/20 0.37
RAB9A P51151 1/20 0.37
MEN1 O00255 1/20 0.36
KMT2A Q03164 1/20 0.36
ALDH1A1 P00352 5/20 0.36
ALOX12 P18054 1/20 0.36
HPGD P15428 3/20 0.36
LMNA P02545 1/20 0.34
GAA P10253 1/20 0.34
FAAH O00519 1/20 0.33
MGLL Q99685 1/20 0.33
ATAD2 Q6PL18 1/20 0.33
S1PR2 O95136 1/20 0.32
HTT P42858 1/20 0.32
NPSR1 Q6W5P4 1/20 0.32

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
SCHEMBL43959 0.82 TSHR (0.39) TSHRSMN1; SMN2RAB9AMEN1KMT2A
Hydrochloric Acid SCHEMBL17595174 0.81 TSHR (0.38) TSHRSMN1; SMN2RAB9AMEN1KMT2A
Hydroxyamine SCHEMBL3213770 0.79 TSHR (0.37) TSHRSMN1; SMN2RAB9AMEN1KMT2A
SCHEMBL16841649 0.75 TSHR (0.42) TSHRSMN1; SMN2RAB9AMEN1KMT2A
SCHEMBL4381244 0.75 KMT2A (0.36) TSHRSMN1; SMN2RAB9AMEN1KMT2A
SCHEMBL2352790 0.73 TSHR (0.31) TSHRSMN1; SMN2RAB9AMEN1KMT2A
SCHEMBL5088057 0.72 TSHR (0.37) TSHRSMN1; SMN2RAB9AMEN1KMT2A
SCHEMBL2423505 0.71
SCHEMBL5091798 0.70 TSHR (0.44) TSHRSMN1; SMN2RAB9AMEN1KMT2A
Edetic Acid SCHEMBL7787575 0.70 TDP1 (0.40) TSHRSMN1; SMN2RAB9ALMNA

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 19 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-103429269-B Contain with the coupling of polyanion polypeptide, derived from the conjugated molecule that is used for the treatment of AIDS of the peptide of CD4 acceptor INSTITUT PASTEUR (FR) 2016-05-11 CN disclosed
CN-104781281-A Conjugates including an antibody moiety, a polypeptide that traverses the blood-brain barrier, and a cytotoxin ANGIOCHEM INC 2015-07-15 CN disclosed
CN-102065884-B Pegylated insulin lispro compounds LILLY CO ELI 2014-11-05 CN disclosed
CN-103561773-A Theranostic imaging agents and methods of use UNIV JOHNS HOPKINS 2014-02-05 CN disclosed
CN-1901934-B Use of erythropoietin in the treatment of disturbances of iron distribution in chronic inflammatory bowel disease HOFFMANN LA ROCHE 2013-09-11 CN disclosed
CN-102781965-A Compositions and methods for the transport of therapeutic agents ANGIOCHEM INC 2012-11-14 CN disclosed
CN-102038955-B Method for preparing anticoagulant polysulfone material by Friedel-crafts reaction grafting Central South University Xiangya School of Medicine 2012-04-18 CN disclosed
CN-102065884-A Pegylated insulin lispro compounds LILLY CO ELI 2011-05-18 CN disclosed
CN-102038955-A Method for preparing anticoagulant polysulfone material by Friedel-crafts reaction grafting XIANGYA HOSPITAL CENTRAL SOUTH UNIV 2011-05-04 CN disclosed
CN-102046203-A Conjugated molecules comprising a peptide derived from the CD4 receptor coupled to a polyanion for the treatment of aids PASTEUR INSTITUT 2011-05-04 CN disclosed
US-7629295-B2 Determination of a specific immunoglobulin using multiple antigens ROCHE DIAGNOSTICS GMBH (DE) 2009-12-08 US disclosed
CN-101421297-A Peptides that block the binding of igg to fcrn SYNTONIX PHARMACEUTICALS INC (US) 2009-04-29 CN disclosed
CN-1309416-C Novel pharmaceutical composition HOFFMANN LA ROCHE (CH) 2007-04-11 CN disclosed
CN-1901934-A Use of erythropoietin in the treatment of disturbances of iron distribution in chronic inflammatory bowel disease HOFFMANN LA ROCHE (CH) 2007-01-24 CN disclosed
US-20050074750-A1 Determination of a specific immunoglobulin using multiple antigens WIENHUES URSULA-HENRIKE (DE) 2005-04-07 US disclosed
US-6613530-B1 Epitopes; antibodies; amino acid sequences; haptens; genetic engineering; chelate compounds; biotin; carriers; use in detection of HIV or Hepatitis C-virus antibodies in liquid sample incubated in presence of solid phase and two antigens ROCHE DIAGNOSTICS GMBH (DE) 2003-09-02 US disclosed
CN-1429116-A Novel pharmaceutical composition HOFFMANN LA ROCHE (CH) 2003-07-09 CN disclosed
CN-1102594-C Agent for suppressing interference in immuno assaying ROCHE DIAGNOSTICS GMBH (DE) 2003-03-05 CN disclosed
CN-1143368-A Agent for suppressing interference in immuno assaying BOEHRINGER MANNHEIM GMBH (DE) 1997-02-19 CN disclosed