SCHEMBL756443

SCHEMBL756443

CC(C)(C)OC(=O)NOCCCCN1C(=O)c2ccccc2C1=O

nearest known ligand 0.48

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
HDAC8 Q9BY41 4/20 0.47
HDAC7 Q8WUI4 4/20 0.47
HDAC3 O15379 3/20 0.47
HDAC4 P56524 3/20 0.47
HDAC1 Q13547 3/20 0.47
HDAC2 Q92769 3/20 0.47
HDAC10 Q969S8 3/20 0.47
HDAC11 Q96DB2 3/20 0.47
HDAC6 Q9UBN7 3/20 0.47
HDAC9 Q9UKV0 3/20 0.47
HDAC5 Q9UQL6 3/20 0.47
SMN1; SMN2 Q16637 3/20 0.45
MAPT P10636 1/20 0.45
RAB9A P51151 1/20 0.45
HPGD P15428 4/20 0.45
ALDH1A1 P00352 2/20 0.45
LMNA P02545 2/20 0.45
TSHR P16473 2/20 0.45
NPSR1 Q6W5P4 1/20 0.45
KMT2A Q03164 2/20 0.44

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
SCHEMBL12028798 0.96 SMN1; SMN2 (0.49) HDAC8HDAC7HDAC3HDAC4HDAC1
SCHEMBL12029011 0.91 SMN1; SMN2 (0.48) SMN1; SMN2RAB9AHPGDALDH1A1LMNA
SCHEMBL19041096 0.82 MAPT (0.51) HDAC8HDAC7HDAC3HDAC4HDAC1
SCHEMBL8139824 0.82 BRD4 (0.53) HDAC8HDAC7HDAC3HDAC4HDAC1
SCHEMBL9773851 0.81 TPSAB1 (0.54) HDAC8HDAC7HDAC3HDAC4HDAC1
SCHEMBL22291518 0.81 TPSAB1 (0.54) HDAC8HDAC7HDAC3HDAC4HDAC1
SCHEMBL31655700 0.81 TPSAB1 (0.54) HDAC8HDAC7HDAC3HDAC4HDAC1
SCHEMBL25974776 0.81 MALT1 (0.52) HDAC8HDAC7HDAC3HDAC4HDAC1
SCHEMBL13881414 0.80 GAA (0.51) SMN1; SMN2MAPTALDH1A1KMT2AMEN1
SCHEMBL8796544 0.79 SMN1; SMN2 (0.55) HDAC8HDAC7HDAC3HDAC4HDAC1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2842576-B1 Transglutaminase mediated conjugation of peptides NOVO NORDISK HEALTHCARE AG (CH) 2017-06-28 EP disclosed
EP-2842576-B1 Transglutaminase mediated conjugation of peptides NOVO NORDISK HEALTHCARE AG (CH) 2017-06-28 EP disclosed
US-20160355859-A1 TRANSGLUTAMINASE MEDIATED CONJUGATION OF PEPTIDES NOVO NORDISK A/S (DK) 2016-12-08 US disclosed
US-20160355859-A1 TRANSGLUTAMINASE MEDIATED CONJUGATION OF PEPTIDES NOVO NORDISK A/S (DK) 2016-12-08 US disclosed
US-20160355859-A1 TRANSGLUTAMINASE MEDIATED CONJUGATION OF PEPTIDES NOVO NORDISK A/S (DK) 2016-12-08 US disclosed
EP-2842576-A1 Transglutaminase mediated conjugation of peptides Novo Nordisk Health Care AG (CH) 2015-03-04 EP disclosed
EP-2842576-A1 Transglutaminase mediated conjugation of peptides Novo Nordisk Health Care AG (CH) 2015-03-04 EP disclosed
US-20140274903-A1 USE OF GALACTOSE OXIDASE FOR SELECTIVE CHEMICAL CONJUGATION OF PROTRACTOR MOLECULES TO PROTEINS OF THERAPEUTIC INTEREST NOVO NORDISK HEALTHCARE AG (CH) 2014-09-18 US disclosed
US-20140274903-A1 USE OF GALACTOSE OXIDASE FOR SELECTIVE CHEMICAL CONJUGATION OF PROTRACTOR MOLECULES TO PROTEINS OF THERAPEUTIC INTEREST NOVO NORDISK HEALTHCARE AG (CH) 2014-09-18 US disclosed
US-20140274903-A1 USE OF GALACTOSE OXIDASE FOR SELECTIVE CHEMICAL CONJUGATION OF PROTRACTOR MOLECULES TO PROTEINS OF THERAPEUTIC INTEREST NOVO NORDISK HEALTHCARE AG (CH) 2014-09-18 US disclosed
EP-1708755-A2 TRANSGLUTAMINASE MEDIATED CONJUGATION OF PEPTIDES NOVO NORDISK A/S (DK) 2006-10-11 EP disclosed
US-20060198819-A1 Use of galactose oxidase for selective chemical conjugation of protractor molecules to proteins of therapeutic interest NOVO NORDISK HEALTHCARE A/G (CH) 2006-09-07 US disclosed
WO-2006087354-A2 INSULINOTROPIC AGENTS CONJUGATED WITH STRUCTURALLY WELL DEFINED BRANCHED POLYMERS NOVO NORDISK A/S (DK) 2006-08-24 WO disclosed
US-20060182714-A1 Synthesis and application of new structural well defined branched polymers as conjugating agents for peptides NOVO NORDISK A/S (DK) 2006-08-17 US disclosed
WO-2006084888-A2 C-TERMINALLY PEGYLATED GROWTH HORMONES NOVO NORDISK A/S (DK) 2006-08-17 WO disclosed
EP-1688150-A1 Process for the preparation of alkoxyamine functionalised poly ethylene glycols NOVO NORDISK A/S (DK) 2006-08-09 EP disclosed
WO-2006079641-A2 INSULIN DERIVATIVES CONJUGATED WITH STRUCTURALLY WELL DEFINED BRANCHED POLYMERS NOVO NORDISK A/S (DK) 2006-08-03 WO disclosed
EP-1673387-A1 IL-21 DERIVATIVES NOVO NORDISK A/S (DK) 2006-06-28 EP disclosed
WO-2005070468-A2 TRANSGLUTAMINASE MEDIATED CONJUGATION OF PEPTIDES NOVO NORDISK A/S (DK) 2005-08-04 WO disclosed
WO-2005035565-A1 IL-21 DERIVATIVES NOVO NORDISK A/S (DK) 2005-04-21 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 (4 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-20060198819-A1 Use of galactose oxidase for selective chemical conjugation of protractor molecules to proteins of therapeutic interest GALE, GALNT2, GALNT1 HDAC8 2544/4885HDAC7 3111/4885HDAC3 2404/4885
US-20060182714-A1 Synthesis and application of new structural well defined branched polymers as conjugating agents for peptides VIP, PTMS, PDGFA HDAC8 3746/4885HDAC7 3921/4885HDAC3 3944/4885
US-20140274903-A1 USE OF GALACTOSE OXIDASE FOR SELECTIVE CHEMICAL CONJUGATION OF PROTRACTOR MOLECULES TO PROTEINS OF THERAPEUTIC INTEREST GALE, GALNT2, GALNT1 HDAC8 2544/4885HDAC7 3111/4885HDAC3 2404/4885
US-20160355859-A1 TRANSGLUTAMINASE MEDIATED CONJUGATION OF PEPTIDES TGM2, TGM3, TGM1 HDAC8 2501/4885HDAC7 3048/4885HDAC3 3998/4885

“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.