SCHEMBL10170685

SCHEMBL10170685

CCCCCCCCCCCCCCCC(=O)NS(=O)(=O)CCCCCC(=O)NN

nearest known ligand 0.46

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
HSP90AA1 P07900 1/20 0.46
CTSD P07339 1/20 0.46
FAAH O00519 6/20 0.44
MEN1 O00255 1/20 0.42
MAPK1 P28482 1/20 0.42
KMT2A Q03164 1/20 0.42
EPHX2 P34913 1/20 0.42
DNM1 Q05193 1/20 0.41
ALDH1A1 P00352 1/20 0.41
CA1 P00915 1/20 0.39
CA2 P00918 1/20 0.39
CYP1A2 P05177 1/20 0.39
CYP3A4 P08684 1/20 0.39
CYP2C19 P33261 1/20 0.39
GAA P10253 1/20 0.39

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
SCHEMBL765884 1.00 HSP90AA1 (0.46) HSP90AA1CTSDFAAHMEN1MAPK1
SCHEMBL4732400 0.92 HSP90AA1 (0.53) HSP90AA1FAAHMEN1MAPK1KMT2A
SCHEMBL4732709 0.92 HSP90AA1 (0.53) HSP90AA1FAAHMEN1MAPK1KMT2A
SCHEMBL4731984 0.92 HSP90AA1 (0.53) HSP90AA1FAAHMEN1MAPK1KMT2A
SCHEMBL8292801 0.88 HSP90AA1 (0.53) HSP90AA1FAAHMEN1MAPK1KMT2A
SCHEMBL8292803 0.88 HSP90AA1 (0.53) HSP90AA1FAAHMEN1MAPK1KMT2A
SCHEMBL14166663 0.88 HSP90AA1 (0.48) HSP90AA1FAAHMEN1MAPK1KMT2A
SCHEMBL16076994 0.85 HSP90AA1 (0.47) HSP90AA1FAAHMEN1MAPK1KMT2A
SCHEMBL946992 0.82 CTSD (0.65) HSP90AA1CTSDFAAHMEN1MAPK1
SCHEMBL1272524 0.82 CTSD (0.65) HSP90AA1CTSDFAAHMEN1MAPK1

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 9 patents. 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
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-2033662-B1 Transglutaminase mediated conjugation of peptides NOVO NORDISK HEALTHCARE AG (CH) 2012-10-17 EP disclosed
EP-1708755-B1 TRANSGLUTAMINASE MEDIATED CONJUGATION OF PEPTIDES NOVO NORDISK HEALTHCARE AG (CH) 2012-03-21 EP disclosed
EP-2368579-A1 Transglutaminase mediated conjugation of peptides Novo Nordisk Health Care AG (CH) 2011-09-28 EP disclosed
US-20100028939-A1 Use of Galactose Oxidase for Selective Chemical Conjugation of Protractor Molecules to Proteins of Therapeutic Interest NOVO NORDISK HEALTHCARE A/G (CH) 2010-02-04 US disclosed
US-7524813-B2 Selectively conjugated peptides and methods of making the same NOVO NORDISK HEALTH CARE AG (CH) 2009-04-28 US disclosed
EP-2033662-A1 Transglutaminase mediated conjugation of peptides Novo Nordisk Health Care AG (CH) 2009-03-11 EP 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 (2 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-20160355859-A1 TRANSGLUTAMINASE MEDIATED CONJUGATION OF PEPTIDES TGM2, TGM3, TGM1 HSP90AA1 955/4885CTSD 565/4885FAAH 2760/4885
US-20100028939-A1 Use of Galactose Oxidase for Selective Chemical Conjugation of Protractor Molecules to Proteins of Therapeutic Interest GALE, GALNT2, GALNT1 HSP90AA1 1940/4885CTSD 598/4885FAAH 3092/4885

“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.