SCHEMBL751108

SCHEMBL751108

CCCOCCNC(=O)CCN1C(=O)C=CC1=O

nearest known ligand 0.45

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MGLL Q99685 3/20 0.45
SMN1; SMN2 Q16637 2/20 0.39
HPGD P15428 2/20 0.39
HTT P42858 1/20 0.39
PTGS1 P23219 7/20 0.39
PTGS2 P35354 7/20 0.39
FAAH O00519 1/20 0.39
CYP2C19 P33261 2/20 0.38
ALDH1A1 P00352 1/20 0.37
CYP1A2 P05177 1/20 0.37
BLM P54132 1/20 0.37
WRN Q14191 1/20 0.37
HIF1A Q16665 1/20 0.37
GSK3A P49840 1/20 0.36
GSK3B P49841 1/20 0.36
POLB P06746 1/20 0.36
HSD17B10 Q99714 1/20 0.36
CA12 O43570 2/20 0.36
CA1 P00915 2/20 0.36
CA2 P00918 2/20 0.36

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
SCHEMBL45879 0.99 MGLL (0.47) MGLLSMN1; SMN2HPGDHTTPTGS1
SCHEMBL13401579 0.99 MGLL (0.47) MGLLSMN1; SMN2HPGDHTTPTGS1
SCHEMBL26227346 0.99 MGLL (0.47) MGLLSMN1; SMN2HPGDHTTPTGS1
SCHEMBL13311214 0.99 MGLL (0.47) MGLLSMN1; SMN2HPGDHTTPTGS1
SCHEMBL13324706 0.99 MGLL (0.47) MGLLSMN1; SMN2HPGDHTTPTGS1
SCHEMBL24621630 0.99 MGLL (0.47) MGLLSMN1; SMN2HPGDHTTPTGS1
SCHEMBL16172443 0.93 MGLL (0.52) MGLLSMN1; SMN2HPGDHTTPTGS1
SCHEMBL13226858 0.92 MGLL (0.42) MGLLSMN1; SMN2HPGDHTTPTGS1
SCHEMBL15184870 0.92 TSHR (0.43) MGLLSMN1; SMN2PTGS1PTGS2FAAH
SCHEMBL13300934 0.92 MGLL (0.42) MGLLSMN1; SMN2HPGDHTTPTGS1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2023201335-A2 PURIFIED MULTIVALENT PROTEIN-HYALURONIC ACID POLYMER CONJUGATES VALITOR, INC. (US) 2023-10-19 WO disclosed
WO-2023201336-A2 HUMANIZED MULTIVALENT PROTEIN CONJUGATES VALITOR, INC. (US) 2023-10-19 WO disclosed
US-20170274091-A1 BENZODIAZEPINES AND CONJUGATES THEREOF IMMUNOGEN, INC. 2017-09-28 US disclosed
US-9732084-B2 Pyrrolobenzodiazepines used to treat proliferative diseases MEDIMMUNE LIMITED (GB) 2017-08-15 US disclosed
US-9707301-B2 Pyrrolobenzodiazepines and targeted conjugates SEATTLE GENETICS, INC. (US) 2017-07-18 US disclosed
WO-2017100305-A2 COMPOSITION OF ANTIBODY CONSTRUCT-AGONIST CONJUGATES AND METHODS OF USE THEREOF OPI VI - IP HOLDCO LLC (US) 2017-06-15 WO disclosed
US-20170143846-A1 TARGETED PYRROLOBENZODIAZAPINE CONJUGATES SPIROGEN LIMITED (GB) 2017-05-25 US disclosed
US-9592240-B2 Targeted pyrrolobenzodiazapine conjugates SEATTLE GENETICS INC. (US) 2017-03-14 US disclosed
US-9579367-B2 C-terminally tethered amino acids and their fibrinolytic therapeutic uses CANADIAN BLOOD SERVICES (CA) 2017-02-28 US disclosed
US-9567340-B2 Unsymmetrical pyrrolobenzodiazepines-dimers for use in the treatment of proliferative and autoimmune diseases MEDIMMUNE LIMITED (GB) 2017-02-14 US disclosed
US-7846896-B2 PEG conjugates of NK4 HOFFMAN-LA ROCHE INC. (US) 2010-12-07 US disclosed
US-7846336-B2 regeneration of a cation exchange chromatography column for purification of polypeptides HOFFMANN-LA ROCHE INC. (US) 2010-12-07 US disclosed
US-20090118476-A1 Purification of pegylated polypeptides HOFFMANN-LA ROCHE INC. 2009-05-07 US disclosed
US-20090101585-A1 regeneration of a cation exchange chromatography column for purification of polypeptides HOFFMANN-LA ROCHE INC. 2009-04-23 US disclosed
US-7459436-B2 Treatment of disturbances of iron distribution HOFFMANN-LA ROCHE INC. (US) 2008-12-02 US disclosed
US-7459429-B2 Method of treating disturbances of iron distribution in inflammatory intestinal diseases HOFFMANN-LA ROCHE INC. (US) 2008-12-02 US disclosed
US-7459435-B2 Treatment of disturbances of iron distribution HOFFMANN-LA ROCHE INC. (US) 2008-12-02 US disclosed
US-20080085857-A1 conjugate consisting essentially of a NK4 molecule and a polyethylene glycol group having a molecular weight of from about 20 to about 40 kDa. The invention also provides a composition in which the monoPEGylated conjugates comprise at least 90% of the total of pegylated NK4 molecules and unpegylated NK4 BRANDT MICHAEL 2008-04-10 US disclosed
US-7202208-B2 Erythropoietin composition HOFFMAN-LA ROCHE INC. (US) 2007-04-10 US disclosed
US-7169754-B2 Erythropoietin composition HOFFMANN-LA ROCHE INC. (US) 2007-01-30 US 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 (5 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-20170143846-A1 TARGETED PYRROLOBENZODIAZAPINE CONJUGATES QDPR, SBDS, DNPEP MGLL 4647/4885SMN1; SMN2 3366/4885HPGD 992/4885
US-20170274091-A1 BENZODIAZEPINES AND CONJUGATES THEREOF GABBR1, GABRA1, GABBR2 MGLL 4848/4885SMN1; SMN2 1790/4885HPGD 516/4885
US-20090118476-A1 Purification of pegylated polypeptides EPOR, HAMP, EGFR MGLL 2152/4885SMN1; SMN2 4575/4885HPGD 2602/4885
US-20080085857-A1 conjugate consisting essentially of a NK4 molecule and a polyethylene glycol group having a molecular weight of from about 20 to about 40 kDa. The invention also provides a composition in which the monoPEGylated conjugates comprise at least 90% of the total of pegylated NK4 molecules and unpegylated NK4 PBK, IL4, CD47 MGLL 1850/4885SMN1; SMN2 4743/4885HPGD 2892/4885
US-20090101585-A1 regeneration of a cation exchange chromatography column for purification of polypeptides IAPP, HDGF, HGF MGLL 3689/4885SMN1; SMN2 816/4885HPGD 4036/4885

“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.